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3,5-Bis(trifluoromethyl)phenyl isocyanate, 98%, Thermo Scientific Chemicals Product Code.: 11372147
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3,5-Bis(trifluoromethyl)phenyl isocyanate, 98%, Thermo Scientific Chemicals

Product Code. 11372147
5 g
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Quantity:
1 g
5 g
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Product Code. 11372147

Brand: Thermo Scientific Alfa Aesar L09582.06

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Description

3,5-Bis(trifluoromethyl)phenyl isocyanate is used in Chemical derivatization of amino-functionalized model surfaces. Preparation of arylaminothiocarbonylpyridinium zwitterionic salts, via an exothermic reaction with 4-pyrrolidinopyridine. Synthesis of (S)-3-hydroxymethyl-2-methoxymethoxy-2?-(3-(3,5-bis(trifluoromethyl)phenyl)uryl-benzyl)-1,10-binaphthalene. Synthesis of 1-[3,5-bis(trifluoromethyl) phenyl]-3-(2-pyridyl)thiourea, via reaction with 2-amino pyridine in MeCN.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
3,5-Bis(trifluoromethyl)phenyl isocyanate is used in Chemical derivatization of amino-functionalized model surfaces. Preparation of arylaminothiocarbonylpyridinium zwitterionic salts, via an exothermic reaction with 4-pyrrolidinopyridine. Synthesis of (S)-3-hydroxymethyl-2-methoxymethoxy-2′-(3-(3,5-bis(trifluoromethyl)phenyl)uryl-benzyl)-1,10-binaphthalene. Synthesis of 1-[3,5-bis(trifluoromethyl) phenyl]-3-(2-pyridyl)thiourea, via reaction with 2-amino pyridine in MeCN.

Solubility
Hydrolyzes with water.

Notes
Moisture Sensitive. Protect from heat. Store away from heat and oxidizing agents. Store under dry inert gas. Protect from humidity and water. Incompatible with heat, amines, alcohols and oxidizing agents.
TRUSTED_SUSTAINABILITY

Chemical Identifiers

CAS 16588-74-2
Molecular Formula C9H3F6NO
Molecular Weight (g/mol) 255.119
MDL Number MFCD00013559
InChI Key NRSSOFNMWSJECS-UHFFFAOYSA-N
Synonym 3,5-bis trifluoromethyl phenylisocyanate, 3,5-bis trifluoromethyl phenyl isocyanate, 1-isocyanato-3,5-bis trifluoromethyl benzene, 3,5-bis trifluoromethyl isocyanate, 3,5-di trifluoromethyl phenyl isocyanate, 3,5-di trifluoromethyl phenylisocyanate, 3,5-bis trifluoromethyl benzenisocyanate, pubchem2735, acmc-209dtj, 3,5-bistrifluorometylphenylisocyanateShow MoreShow Less
PubChem CID 2733314
IUPAC Name 1-isocyanato-3,5-bis(trifluoromethyl)benzene
SMILES C1=C(C=C(C=C1C(F)(F)F)N=C=O)C(F)(F)F

Specifications

Density 1.476
Boiling Point 62°C (2 mmHg)
Flash Point 67°C (152°F)
Odor Pungent
Refractive Index 1.43
Quantity 5 g
UN Number UN2206
Beilstein 542272
Sensitivity Moisture sensitive
Solubility Information Hydrolyzes with water.
Formula Weight 255.12
Percent Purity 98%
Chemical Name or Material 3,5-Bis(trifluoromethyl)phenyl isocyanate
Show More Show Less

Certificates

Certificates

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5 results found
Lot Number Certificate Type Date Catalog Number
Lot Number10246835 Certificate TypeCertificate of Analysis Date07/08/2023 Catalog NumberL09582.06,L09582.03
Lot Number10243838 Certificate TypeCertificate of Analysis Date13/10/2022 Catalog NumberL09582.06,L09582.03
Lot Number10157458 Certificate TypeCertificate of Analysis Date08/12/2021 Catalog NumberL09582.06,L09582.03
Lot Number10221858 Certificate TypeCertificate of Analysis Date08/12/2021 Catalog NumberL09582.06,L09582.03
Lot NumberC15S028 Certificate TypeCertificate of Analysis Date07/12/2021 Catalog NumberL09582.06,L09582.03

Safety and Handling

compliance-icons
Product Identifier
  • 3,5-Bis(trifluoromethyl)phenyl isocyanate
 Signal Word
  • Warning
 Hazard Category
  • Acute toxicity Category 4
  • Serious eye damage/eye irritation Category 2
  • Skin corrosion/irritation Category 2
  • Specific target organ toxicity Category 3
 Hazard Statement
  • H302-Harmful if swallowed.
  • H312-Harmful in contact with skin.
  • H315-Causes skin irritation.
  • H319-Causes serious eye irritation.
  • H332-Harmful if inhaled.
  • H335-May cause respiratory irritation.
 Precautionary Statement
  • P261-Avoid breathing dust/fume/gas/mist/vapours/spray.
  • P280-Wear protective gloves/protective clothing/eye protection/face protection.
  • P301+P312-IF SWALLOWED: Call a POISON CENTER or doctor/physician/ if you feel unwell.
  • P302+P352-IF ON SKIN: Wash with plenty of water/soap.
  • P304+P340-IF INHALED: Remove person to fresh air and keep comfortable for breathing.
  • P305+P351+P338-IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
 Supplemental information
  • MIXTURE LIST-Contains : 1-Isocyanato-3,5-bis(trifluoromethyl)benzene
SDS

RUO – Research Use Only

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