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3-Bromo-1,1,1-trifluoro-2-propanone

3-Bromo-1,1,1-trifluoro-2-propanone structure

CAS No:
431-35-6
Formula:
C3H2BrF3O
Chemical Name:
3-Bromo-1,1,1-trifluoro-2-propanone
Synonyms:
2-Propanone,3-bromo-1,1,1-trifluoro-;3-Bromo-1,1,1-trifluoro-2-propanone;Bromotrifluoro-2-propanone;1,1,1-Trifluoro-3-bromoacetone;3-Bromo-1,1,1-trifluoropropanone;3,3,3-Trifluorobromoacetone;3-Bromo-1,1,1-trifluoroacetone;1,1,1-Trifluoro-3-bromopropanone;1-Bromo-3,3,3-trifluoro-2-propanone;Bromotrifluoroacetone;Bromomethyl trifluoromethyl ketone;1,1,1-Trifluoro-3-bromo-2-propanone;1-Bromo-3,3,3-trifluoroacetone
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Description

clear colorless to yellowish liquid

3-Bromo-1,1,1-trifluoro-2-propanone Basic Attributes

Molecular Weight：

190.947

Exact Mass：

190.95

EC Number：

207-071-9

UNII：

53REV65E85

DSSTox ID：

DTXSID30195690

HScode：

2914700090

Characteristics

PSA：

17.07000

XLogP3：

1.95

Appearance：

light yellow liquid

Density：

1.8±0.1 g/cm3

Melting Point：

Boiling Point：

84.7 °C @ Press: 743.8 Torr

Flash Point：

5.0±0.0 °C

Refractive Index：

1.378

Water Solubility：

Immiscible with water.

Storage Conditions：

Flammables area

Vapor Pressure：

26.5mmHg at 25°C

Safety Information

Packing level：

Hazard category：

Transport codes：

UN 2924 3/PG 2

wgk germany：

hazard class code：

R11;R34

safety instructions：

S16-S26-S36/37/39-S45

Marks：

F:Flammable;C:Corrosive;

Precautionary statement(s)：

P210-P280-P305 + P351 + P338-P310

Hazard Statements：

H225-H314

GHS Classification：

|Danger|H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]|P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P370+P378, P403+P235, P405, and P501|Aggregated GHS information provided by 51 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

3,3,3-trifluorobromoacetone

Computed Properties

Molecular Weight:190.95
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:189.92411
Monoisotopic Mass:189.92411
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:97.2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Bromo-1,1,1-trifluoro-2-propanone

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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3-Bromo-1,1,1-trifluoro-2-propanone

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