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4-Chloro-2-(trifluoromethyl)phenyl isocyanate, 97%

Catalog No. p-7045214
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AAL0985003 1 g
AAL0985006 5 g
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Catalog No. AAL0985003 Supplier Thermo Scientific Chemicals Supplier No. L0985003
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CAS: 16588-69-5 | C8H3ClF3NO | 221.56 g/mol

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.

Chemical Identifiers

CAS 16588-69-5
Molecular Formula C8H3ClF3NO
Molecular Weight (g/mol) 221.56
MDL Number MFCD00013873
InChI Key SBDPJLJFODHSFF-UHFFFAOYSA-N
Synonym 4-chloro-2-trifluoromethyl phenyl isocyanate, 4-chloro-1-isocyanato-2-trifluoromethyl benzene, 4-chloro-2-trifluoromethyl phenylisocyanate, 5-chloro-2-isocyanatobenzotrifluoride, timtec-bb sbb006655, 4-chloro-2-trifluoromethyl benzenisocyanate, pubchem4450, acmc-1c7bp, 4-chloro-2-trifluoromethylphenyl isocyanate, 4-chloro-2-trifluoromethyl-isocyanatobenzene
PubChem CID 2733264
IUPAC Name 4-chloro-1-isocyanato-2-(trifluoromethyl)benzene
SMILES FC(F)(F)C1=C(C=CC(Cl)=C1)N=C=O

Specifications

Density 1.467
Boiling Point 114°C to 115°C (10 mmHg)
Flash Point 94°C (201°F)
Odor Pungent
Refractive Index 1.501
Quantity 1 g
UN Number UN2206
Beilstein 2214336
Sensitivity Moisture sensitive
Formula Weight 221.57
Percent Purity 97%
Chemical Name or Material 4-Chloro-2-(trifluoromethyl)phenyl isocyanate
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Hazard Category H302+H312+H332-H315-H319-H334-H335
Hazard Statement GHS H Statement
H331-H334-H302-H315-H319-H335
Toxic if inhaled.
May cause allergy or asthma symptoms or breathing difficulties if inhaled.
Harmful if swallowed.
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.
Precautionary Statement P261-P264b-P270-P271-P280-P285-P301+P312-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P342+P311-P362-P501c
DOTInformation Transport Hazard Class: 6.1; Packing Group: III; Proper Shipping Name: ISOCYANATES, TOXIC, N.O.S.
EINECSNumber 000-000-0
TSCA No
Recommended Storage Keep cold

RUO – Research Use Only