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Benzoxazoles

Benzoxazoles

Organic heterocyclic compounds that consist of benzene fused with an oxazoles; oxazoles are azoles with an oxygen atom and a nitrogen atom separated by one carbon.
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1 – 15 of 33 results
1

5-Methylbenzoxazole, 99%, Thermo Scientific Chemicals

CAS: 10531-78-9 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00216938 InChI Key: UBIAVBGIRDRQLD-UHFFFAOYSA-N Synonym: 5-methylbenzoxazole,5-methylbenzo d oxazole,5-methylbenzooxazole,5-methyl-benzoxazole,pubchem8638,acmc-1bprw,5-methylbenzo d oxazole;5-methylbenzo d oxazole PubChem CID: 2724970 IUPAC Name: 5-methyl-1,3-benzoxazole SMILES: CC1=CC=C2OC=NC2=C1

PubChem CID 2724970
CAS 10531-78-9
Molecular Weight (g/mol) 133.15
MDL Number MFCD00216938
SMILES CC1=CC=C2OC=NC2=C1
Synonym 5-methylbenzoxazole,5-methylbenzo d oxazole,5-methylbenzooxazole,5-methyl-benzoxazole,pubchem8638,acmc-1bprw,5-methylbenzo d oxazole;5-methylbenzo d oxazole
IUPAC Name 5-methyl-1,3-benzoxazole
InChI Key UBIAVBGIRDRQLD-UHFFFAOYSA-N
Molecular Formula C8H7NO
2

5-Fluorobenzoxazole, 97%, Thermo Scientific™

CAS: 221347-71-3 Molecular Formula: C7H4FNO Molecular Weight (g/mol): 137.11 InChI Key: ZRMPAEOUOPNNPZ-UHFFFAOYSA-N Synonym: 5-fluorobenzoxazole,5-fluorobenzo d oxazole,benzoxazole, 5-fluoro,benzoxazole,5-fluoro,pubchem21888,5-fluoranyl-1,3-benzoxazole,benzoxazole, 5-fluoro-9ci PubChem CID: 19937167 IUPAC Name: 5-fluoro-1,3-benzoxazole SMILES: C1=CC2=C(C=C1F)N=CO2

PubChem CID 19937167
CAS 221347-71-3
Molecular Weight (g/mol) 137.11
SMILES C1=CC2=C(C=C1F)N=CO2
Synonym 5-fluorobenzoxazole,5-fluorobenzo d oxazole,benzoxazole, 5-fluoro,benzoxazole,5-fluoro,pubchem21888,5-fluoranyl-1,3-benzoxazole,benzoxazole, 5-fluoro-9ci
IUPAC Name 5-fluoro-1,3-benzoxazole
InChI Key ZRMPAEOUOPNNPZ-UHFFFAOYSA-N
Molecular Formula C7H4FNO
3

Benzoxazole, 97+%, Thermo Scientific Chemicals

CAS: 273-53-0 Molecular Formula: C7H5NO Molecular Weight (g/mol): 119.12 MDL Number: MFCD00005765 InChI Key: BCMCBBGGLRIHSE-UHFFFAOYSA-N Synonym: benzoxazole,1-oxa-3-azaindene,1-oxa-3-aza-1h-indene,benzo d oxazole,benzooxazole,usaf ek-5017,unii-j233y1i55i,benzoxazol,benzoxazoline,benzothiazoie PubChem CID: 9228 ChEBI: CHEBI:38814 IUPAC Name: 1,3-benzoxazole SMILES: O1C=NC2=CC=CC=C12

PubChem CID 9228
CAS 273-53-0
Molecular Weight (g/mol) 119.12
ChEBI CHEBI:38814
MDL Number MFCD00005765
SMILES O1C=NC2=CC=CC=C12
Synonym benzoxazole,1-oxa-3-azaindene,1-oxa-3-aza-1h-indene,benzo d oxazole,benzooxazole,usaf ek-5017,unii-j233y1i55i,benzoxazol,benzoxazoline,benzothiazoie
IUPAC Name 1,3-benzoxazole
InChI Key BCMCBBGGLRIHSE-UHFFFAOYSA-N
Molecular Formula C7H5NO
4

2-Amino-5-chlorobenzoxazole, 97%, Thermo Scientific Chemicals

CAS: 61-80-3 Molecular Formula: C7H5ClN2O Molecular Weight (g/mol): 168.58 MDL Number: MFCD00005770 InChI Key: YGCODSQDUUUKIV-UHFFFAOYSA-N Synonym: zoxazolamine,2-amino-5-chlorobenzoxazole,5-chlorobenzo d oxazol-2-amine,flexin,2-benzoxazolamine, 5-chloro,contrazole,deflexol,flexilon,zoxamin,zoxine PubChem CID: 6103 ChEBI: CHEBI:35053 IUPAC Name: 5-chloro-1,3-benzoxazol-2-amine SMILES: NC1=NC2=CC(Cl)=CC=C2O1

PubChem CID 6103
CAS 61-80-3
Molecular Weight (g/mol) 168.58
ChEBI CHEBI:35053
MDL Number MFCD00005770
SMILES NC1=NC2=CC(Cl)=CC=C2O1
Synonym zoxazolamine,2-amino-5-chlorobenzoxazole,5-chlorobenzo d oxazol-2-amine,flexin,2-benzoxazolamine, 5-chloro,contrazole,deflexol,flexilon,zoxamin,zoxine
IUPAC Name 5-chloro-1,3-benzoxazol-2-amine
InChI Key YGCODSQDUUUKIV-UHFFFAOYSA-N
Molecular Formula C7H5ClN2O
5

Methyl 2-methyl-1,3-benzoxazole-5-carboxylate, 97%, Thermo Scientific Chemicals

CAS: 136663-21-3 Molecular Formula: C10H9NO3 Molecular Weight (g/mol): 191.19 MDL Number: MFCD07774245 InChI Key: UFLDNRAXHGPDOD-UHFFFAOYSA-N Synonym: methyl 2-methylbenzo d oxazole-5-carboxylate,5-benzoxazolecarboxylicacid, 2-methyl-, methyl ester,acmc-1c498,methyl2-methyl-1,3-benzoxazole-5-carboxylate,methyl 2-methylbenzoxazole-5-carboxylate,5-methoxycarbonyl-2-methyl-1,3-benzoxazole,methyl 2-methyl-1?3-benzoxazole-5-carboxylate,2-methylbenzoxazole-5-carboxylic acid methyl ester,5-benzoxazolecarboxylicacid,2-methyl-,methyl ester,5-benzoxazolecarboxylic acid, 2-methyl-, methyl ester PubChem CID: 12157466 IUPAC Name: methyl 2-methyl-1,3-benzoxazole-5-carboxylate SMILES: CC1=NC2=C(O1)C=CC(=C2)C(=O)OC

PubChem CID 12157466
CAS 136663-21-3
Molecular Weight (g/mol) 191.19
MDL Number MFCD07774245
SMILES CC1=NC2=C(O1)C=CC(=C2)C(=O)OC
Synonym methyl 2-methylbenzo d oxazole-5-carboxylate,5-benzoxazolecarboxylicacid, 2-methyl-, methyl ester,acmc-1c498,methyl2-methyl-1,3-benzoxazole-5-carboxylate,methyl 2-methylbenzoxazole-5-carboxylate,5-methoxycarbonyl-2-methyl-1,3-benzoxazole,methyl 2-methyl-1?3-benzoxazole-5-carboxylate,2-methylbenzoxazole-5-carboxylic acid methyl ester,5-benzoxazolecarboxylicacid,2-methyl-,methyl ester,5-benzoxazolecarboxylic acid, 2-methyl-, methyl ester
IUPAC Name methyl 2-methyl-1,3-benzoxazole-5-carboxylate
InChI Key UFLDNRAXHGPDOD-UHFFFAOYSA-N
Molecular Formula C10H9NO3
6

2-Methylbenzoxazole, 97%, Thermo Scientific Chemicals

CAS: 95-21-6 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00005771 InChI Key: DQSHFKPKFISSNM-UHFFFAOYSA-N Synonym: 2-methylbenzoxazole,2-methylbenzo d oxazole,2-methylbenzoxazol,benzoxazole, 2-methyl,2-methyl-benzoxazole,usaf ek-982,2-methyl-benzooxazole,2-methyl-4,5-benzoxazole,2-methylbenzoxazol czech,unii-z0p021v3ti PubChem CID: 7225 ChEBI: CHEBI:51603 IUPAC Name: 2-methyl-1,3-benzoxazole SMILES: CC1=NC2=CC=CC=C2O1

PubChem CID 7225
CAS 95-21-6
Molecular Weight (g/mol) 133.15
ChEBI CHEBI:51603
MDL Number MFCD00005771
SMILES CC1=NC2=CC=CC=C2O1
Synonym 2-methylbenzoxazole,2-methylbenzo d oxazole,2-methylbenzoxazol,benzoxazole, 2-methyl,2-methyl-benzoxazole,usaf ek-982,2-methyl-benzooxazole,2-methyl-4,5-benzoxazole,2-methylbenzoxazol czech,unii-z0p021v3ti
IUPAC Name 2-methyl-1,3-benzoxazole
InChI Key DQSHFKPKFISSNM-UHFFFAOYSA-N
Molecular Formula C8H7NO
7

6-bromo-1,3-benzoxazol-2(3h)-one, 97%, Thermo Scientific™

CAS: 19932-85-5 Molecular Formula: C7H4BrNO2 Molecular Weight (g/mol): 214.02 MDL Number: MFCD00694727 InChI Key: DDNKJFBQMQOIKI-UHFFFAOYSA-N Synonym: 6-bromobenzo d oxazol-2 3h-one,6-bromo-2-benzoxazolinone,6-bromo-1,3-benzoxazol-2 3h-one,2-benzoxazolinone, 6-bromo,6-bromobenzoxazolinone,2 3h-benzoxazolone, 6-bromo,6-bromo-2 3h-benzoxazolone,cincreasin,6-bromo-2,3-dihydro-1,3-benzoxazol-2-one,6-bromobenzoxazol-2 3h-one PubChem CID: 29859 ChEBI: CHEBI:77861 IUPAC Name: 6-bromo-3H-1,3-benzoxazol-2-one SMILES: BrC1=CC=C2NC(=O)OC2=C1

PubChem CID 29859
CAS 19932-85-5
Molecular Weight (g/mol) 214.02
ChEBI CHEBI:77861
MDL Number MFCD00694727
SMILES BrC1=CC=C2NC(=O)OC2=C1
Synonym 6-bromobenzo d oxazol-2 3h-one,6-bromo-2-benzoxazolinone,6-bromo-1,3-benzoxazol-2 3h-one,2-benzoxazolinone, 6-bromo,6-bromobenzoxazolinone,2 3h-benzoxazolone, 6-bromo,6-bromo-2 3h-benzoxazolone,cincreasin,6-bromo-2,3-dihydro-1,3-benzoxazol-2-one,6-bromobenzoxazol-2 3h-one
IUPAC Name 6-bromo-3H-1,3-benzoxazol-2-one
InChI Key DDNKJFBQMQOIKI-UHFFFAOYSA-N
Molecular Formula C7H4BrNO2
8

2-Mercaptobenzoxazole, 98+%, Thermo Scientific Chemicals

CAS: 2382-96-9 Molecular Formula: C7H5NOS Molecular Weight (g/mol): 151.183 MDL Number: MFCD00005769 InChI Key: FLFWJIBUZQARMD-UHFFFAOYSA-N Synonym: 2-mercaptobenzoxazole,benzo d oxazole-2-thiol,2-benzoxazolethiol,2 3h-benzoxazolethione,benzoxazole-2-thiol,2-benzoxazolinethione,1,3-benzoxazole-2-thiol,benzoxazolinethione,2-mercapto-1,3-benzoxazole,benzooxazole-2-thiol PubChem CID: 712377 IUPAC Name: 3H-1,3-benzoxazole-2-thione SMILES: C1=CC=C2C(=C1)NC(=S)O2

PubChem CID 712377
CAS 2382-96-9
Molecular Weight (g/mol) 151.183
MDL Number MFCD00005769
SMILES C1=CC=C2C(=C1)NC(=S)O2
Synonym 2-mercaptobenzoxazole,benzo d oxazole-2-thiol,2-benzoxazolethiol,2 3h-benzoxazolethione,benzoxazole-2-thiol,2-benzoxazolinethione,1,3-benzoxazole-2-thiol,benzoxazolinethione,2-mercapto-1,3-benzoxazole,benzooxazole-2-thiol
IUPAC Name 3H-1,3-benzoxazole-2-thione
InChI Key FLFWJIBUZQARMD-UHFFFAOYSA-N
Molecular Formula C7H5NOS
9

2,5-Bis(5-tert-butyl-2-benzoxazolyl)thiophene, 99%, Thermo Scientific Chemicals

CAS: 7128-64-5 Molecular Formula: C26H26N2O2S Molecular Weight (g/mol): 430.566 MDL Number: MFCD00005774 InChI Key: AIXZBGVLNVRQSS-UHFFFAOYSA-N Synonym: bbot,2,5-bis 5-tert-butyl-2-benzoxazolyl thiophene,uvitex ob,2,5-bis 5-tert-butyl benzo d oxazol-2-yl thiophene,bbot 150,2,5-bis 5-tert-butylbenzoxazol-2-yl thiophene,benzoxazole, 2,2'-2,5-thiophenediyl bis 5-1,1-dimethylethyl,unii-w7ur9129gp,fluorescent brightener 184,2,2'-2,5-thiophenediyl bis 5-tert-butylbenzoxazole PubChem CID: 292429 IUPAC Name: 5-tert-butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)thiophen-2-yl]-1,3-benzoxazole SMILES: CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(S3)C4=NC5=C(O4)C=CC(=C5)C(C)(C)C

PubChem CID 292429
CAS 7128-64-5
Molecular Weight (g/mol) 430.566
MDL Number MFCD00005774
SMILES CC(C)(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(S3)C4=NC5=C(O4)C=CC(=C5)C(C)(C)C
Synonym bbot,2,5-bis 5-tert-butyl-2-benzoxazolyl thiophene,uvitex ob,2,5-bis 5-tert-butyl benzo d oxazol-2-yl thiophene,bbot 150,2,5-bis 5-tert-butylbenzoxazol-2-yl thiophene,benzoxazole, 2,2'-2,5-thiophenediyl bis 5-1,1-dimethylethyl,unii-w7ur9129gp,fluorescent brightener 184,2,2'-2,5-thiophenediyl bis 5-tert-butylbenzoxazole
IUPAC Name 5-tert-butyl-2-[5-(5-tert-butyl-1,3-benzoxazol-2-yl)thiophen-2-yl]-1,3-benzoxazole
InChI Key AIXZBGVLNVRQSS-UHFFFAOYSA-N
Molecular Formula C26H26N2O2S
12

2-Chlorobenzoxazole, 98%, Thermo Scientific Chemicals

CAS: 615-18-9 Molecular Formula: C7H4ClNO Molecular Weight (g/mol): 153.57 MDL Number: MFCD00005766 InChI Key: BBVQDWDBTWSGHQ-UHFFFAOYSA-N Synonym: 2-chlorobenzoxazole,benzoxazole, 2-chloro,2-chlorobenzo d oxazole,benzoxazole, chloro,chlorobenzoxazole,2-chlorobenzoxazol,2-chlorobenzooxazole,2-chloro benzoxazole,2-chloro-benzoxazole,2-chloro-benzooxazole PubChem CID: 11986 IUPAC Name: 2-chloro-1,3-benzoxazole SMILES: ClC1=NC2=CC=CC=C2O1

PubChem CID 11986
CAS 615-18-9
Molecular Weight (g/mol) 153.57
MDL Number MFCD00005766
SMILES ClC1=NC2=CC=CC=C2O1
Synonym 2-chlorobenzoxazole,benzoxazole, 2-chloro,2-chlorobenzo d oxazole,benzoxazole, chloro,chlorobenzoxazole,2-chlorobenzoxazol,2-chlorobenzooxazole,2-chloro benzoxazole,2-chloro-benzoxazole,2-chloro-benzooxazole
IUPAC Name 2-chloro-1,3-benzoxazole
InChI Key BBVQDWDBTWSGHQ-UHFFFAOYSA-N
Molecular Formula C7H4ClNO
13

6-Chloro-2-benzoxazolethiol, 99%, Thermo Scientific Chemicals

CAS: 22876-20-6 Molecular Formula: C7H4ClNOS Molecular Weight (g/mol): 185.63 MDL Number: MFCD01456482 InChI Key: HAASPZUBSZGCKU-UHFFFAOYSA-N Synonym: 6-chloro-1,3-benzoxazole-2-thiol,6-chloro-2-mercaptobenzoxazole,6-chloro-2-benzoxazolethiol,6-chlorobenzo d oxazole-2-thiol,2-mercapto-6-chlorobenzoxazole,6-chlorobenzoxazole-2 3h-thione,6-chlorobenzo d oxazole-2 3h-thione,6-chloro-benzooxazole-2-thiol,pubchem8714,6-chlorobenzoxazole-2-thiol PubChem CID: 2119214 IUPAC Name: 6-chloro-3H-1,3-benzoxazole-2-thione SMILES: C1=CC2=C(C=C1Cl)OC(=S)N2

PubChem CID 2119214
CAS 22876-20-6
Molecular Weight (g/mol) 185.63
MDL Number MFCD01456482
SMILES C1=CC2=C(C=C1Cl)OC(=S)N2
Synonym 6-chloro-1,3-benzoxazole-2-thiol,6-chloro-2-mercaptobenzoxazole,6-chloro-2-benzoxazolethiol,6-chlorobenzo d oxazole-2-thiol,2-mercapto-6-chlorobenzoxazole,6-chlorobenzoxazole-2 3h-thione,6-chlorobenzo d oxazole-2 3h-thione,6-chloro-benzooxazole-2-thiol,pubchem8714,6-chlorobenzoxazole-2-thiol
IUPAC Name 6-chloro-3H-1,3-benzoxazole-2-thione
InChI Key HAASPZUBSZGCKU-UHFFFAOYSA-N
Molecular Formula C7H4ClNOS
15

2-Methyl-6-nitrobenzoxazole, 98%, Thermo Scientific Chemicals

CAS: 5683-43-2 Molecular Formula: C8H6N2O3 Molecular Weight (g/mol): 178.147 MDL Number: MFCD00022848 InChI Key: DPVZLXWUFYMLBK-UHFFFAOYSA-N PubChem CID: 79766 IUPAC Name: 2-methyl-6-nitro-1,3-benzoxazole SMILES: CC1=NC2=C(O1)C=C(C=C2)[N+](=O)[O-]

PubChem CID 79766
CAS 5683-43-2
Molecular Weight (g/mol) 178.147
MDL Number MFCD00022848
SMILES CC1=NC2=C(O1)C=C(C=C2)[N+](=O)[O-]
IUPAC Name 2-methyl-6-nitro-1,3-benzoxazole
InChI Key DPVZLXWUFYMLBK-UHFFFAOYSA-N
Molecular Formula C8H6N2O3