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1-Bromo-3,3,3-trifluoroacetone, 97%

CAS: 431-35-6 | C3H2BrF3O | 190.95 g/mol

$92.15 - $1297.49

Chemical Identifiers

CAS 431-35-6
Molecular Formula C3H2BrF3O
Molecular Weight (g/mol) 190.95
MDL Number MFCD00039237
InChI Key ONZQYZKCUHFORE-UHFFFAOYSA-N
Synonym 3-bromo-1,1,1-trifluoroacetone, 1-bromo-3,3,3-trifluoroacetone, bromotrifluoroacetone, 3-bromo-1,1,1-trifluoro-2-propanone, 3-bromo-1,1,1-trifluoropropanone, 1-bromo-3,3,3-trifluoro-2-propanone, 2-propanone, 3-bromo-1,1,1-trifluoro, 1,1,1-trifluoro-3-bromopropanone, 3-bromo-1,1,1-trifluoro-propan-2-one, bromotrifloroacetone
PubChem CID 79008
IUPAC Name 3-bromo-1,1,1-trifluoropropan-2-one
SMILES FC(F)(F)C(=O)CBr
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AAA1494806
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Description

Description

1-Bromo-3,3,3-trifluoroacetone is used in the preparation of 3-nonylthio-1,1,1-trifluoropropan-2-one and perfluoroalkylated trans-allylic alcohols. It is involved in the synthesis of cyclic tetrapeptides. Further, it reacts with potassium enolate of ethyl 4,4,4-trifluoroacetoacetate to produce ethyl 2,4-bis(trifluoromethyl)-4-hydroxydihydro-3-furoate.

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
1-Bromo-3,3,3-trifluoroacetone is used in the preparation of 3-nonylthio-1,1,1-trifluoropropan-2-one and perfluoroalkylated trans-allylic alcohols. It is involved in the synthesis of cyclic tetrapeptides. Further, it reacts with potassium enolate of ethyl 4,4,4-trifluoroacetoacetate to produce ethyl 2,4-bis(trifluoromethyl)-4-hydroxydihydro-3-furoate.

Solubility
Immiscible with water.

Notes
Incompatible with strong oxidizing agents and bases.
Specifications

Chemical Identifiers

431-35-6
190.95
ONZQYZKCUHFORE-UHFFFAOYSA-N
79008
FC(F)(F)C(=O)CBr
C3H2BrF3O
MFCD00039237
3-bromo-1,1,1-trifluoroacetone, 1-bromo-3,3,3-trifluoroacetone, bromotrifluoroacetone, 3-bromo-1,1,1-trifluoro-2-propanone, 3-bromo-1,1,1-trifluoropropanone, 1-bromo-3,3,3-trifluoro-2-propanone, 2-propanone, 3-bromo-1,1,1-trifluoro, 1,1,1-trifluoro-3-bromopropanone, 3-bromo-1,1,1-trifluoro-propan-2-one, bromotrifloroacetone
3-bromo-1,1,1-trifluoropropan-2-one

Specifications

431-35-6
1.822
−2°C (28°F)
C3H2BrF3O
MFCD00039237
UN2924
3-bromo-1,1,1-trifluoroacetone, 1-bromo-3,3,3-trifluoroacetone, bromotrifluoroacetone, 3-bromo-1,1,1-trifluoro-2-propanone, 3-bromo-1,1,1-trifluoropropanone, 1-bromo-3,3,3-trifluoro-2-propanone, 2-propanone, 3-bromo-1,1,1-trifluoro, 1,1,1-trifluoro-3-bromopropanone, 3-bromo-1,1,1-trifluoro-propan-2-one, bromotrifloroacetone
ONZQYZKCUHFORE-UHFFFAOYSA-N
3-bromo-1,1,1-trifluoropropan-2-one
79008
97%
<-80°C
85°C to 87°C
Pungent
1.376
5 g
1703387
Immiscible with water.
FC(F)(F)C(=O)CBr
190.95
190.95
1-Bromo-3,3,3-trifluoroacetone
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Safety and Handling

Safety and Handling

GHS H Statement
H225-H314-H318
Highly flammable liquid and vapour.
Causes severe skin burns and eye damage.
Causes serious eye damage.

P210-P233-P240-P241-P242-P243-P260-P264b-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P363-P370+P378q-P501c

H225-H314

DOTInformation : Transport Hazard Class: 3; Packing Group: II; Proper Shipping Name: FLAMMABLE LIQUIDS, CORROSIVE, N.O.S.

EINECSNumber : 207-071-9

TSCA : No

Recommended Storage : Ambient temperatures

SDS
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RUO – Research Use Only