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4′-Bromo-2,2,2-trifluoroacetophenone

4′-Bromo-2,2,2-trifluoroacetophenone structure

CAS No:
16184-89-7
Formula:
C8H4BrF3O
Chemical Name:
4′-Bromo-2,2,2-trifluoroacetophenone
Synonyms:
Ethanone,1-(4-bromophenyl)-2,2,2-trifluoro-;Acetophenone,4′-bromo-2,2,2-trifluoro-;1-(4-Bromophenyl)-2,2,2-trifluoroethanone;4′-Bromo-2,2,2-trifluoroacetophenone;p-Bromo-α,α,α-trifluoroacetophenone;4′-Bromo-α,α,α-trifluoroacetophenone;4-Bromo-α,α,α-trifluoroacetophenone;4-Bromotrifluoroacetone;4-Bromophenyl trifluoromethyl ketone;2,2,2-Trifluoro-1-(4-bromophenyl)ethanone;1-(4-Bromophenyl)-2,2,2-trifluoroethan-1-one;p-Bromophenyl trifluoromethyl ketone;p-Bromotrifluoroacetophenone
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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Description

Clear light yellow liquid

4′-Bromo-2,2,2-trifluoroacetophenone Basic Attributes

Molecular Weight：

253.02

Exact Mass：

253.02

EC Number：

1592732-453-0

DSSTox ID：

DTXSID00345342

HScode：

29147000

Characteristics

PSA：

17.1

XLogP3：

2.8

Appearance：

pale yellow transparent liquid

Density：

1.662 g/mL at 25 °C(lit.)

Melting Point：

29-29.5 °C

Boiling Point：

72 °C @ Press: 6 Torr

Flash Point：

205 °F

Refractive Index：

1.4610 (estimate)

Water Solubility：

Slightly soluble in water.

Vapor Pressure：

0.0845mmHg at 25°C

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:253.02
XLogP3:2.8
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:251.93976
Monoisotopic Mass:251.93976
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:194
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 16184-89-7

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CAS No.: 16184-89-7

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Guide of 4′-Bromo-2,2,2-trifluoroacetophenone

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
Recommended Suppliers
Latest News
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4′-Bromo-2,2,2-trifluoroacetophenone

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