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2-bromo-3-methyl-1-phenylbutan-1-one

2-bromo-3-methyl-1-phenylbutan-1-one structure

CAS No:
50735-03-0
Formula:
C11H13BrO
Chemical Name:
2-bromo-3-methyl-1-phenylbutan-1-one
Synonyms:
2-bromo-3-methyl-1-phenylbutan-1-one;1-Butanone, 2-bromo-3-methyl-1-phenyl-;SCHEMBL2026667;CTK4J3067;DTXSID50446136;alpha-Bromo-beta-methylbutyrophenone;AKOS000210997;AKOS022179034;2-bromo-3-methyl-1-phenyl-1-butanone;EN300-42834

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2-bromo-3-methyl-1-phenylbutan-1-one Basic Attributes

Molecular Weight：

241.128

Exact Mass：

240.01500

DSSTox ID：

DTXSID50446136

HScode：

2914700090

Characteristics

PSA：

17.1

XLogP3：

3.28880

Density：

1.307 g/cm3

Boiling Point：

276.05ºC at 760 mmHg

Flash Point：

38.099ºC

Safety Information

GHS Classification：

|Warning|H227 (100%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:241.12
XLogP3:3.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:240.01498
Monoisotopic Mass:240.01498
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:171
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-bromo-3-methyl-1-phenylbutan-1-one

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-bromo-3-methyl-1-phenylbutan-1-one

SDS

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