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1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE

1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE structure

CAS No:
898760-94-6
Formula:
C12H14BrClO
Chemical Name:
1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE
Synonyms:
1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE;1-(4-bromo-3-methylphenyl)-5-chloropentan-1-one;MFCD03844177;CTK5G4365;DTXSID30645145;ZINC2517989;AKOS016022579

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1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE Basic Attributes

Molecular Weight：

289.6

Exact Mass：

287.992

DSSTox ID：

DTXSID30645145

HScode：

2914700090

Characteristics

PSA：

17.1

XLogP3：

3.9

Density：

1.351g/cm3

Boiling Point：

385.2ºC at 760 mmHg

Flash Point：

186.7ºC

Refractive Index：

1.542

Computed Properties

Molecular Weight:289.59
XLogP3:3.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:287.99166
Monoisotopic Mass:287.99166
Topological Polar Surface Area:17.1
Heavy Atom Count:15
Complexity:208
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE

Basic Attributes
Characteristics
Computed Properties

1-(4-BROMO-3-METHYLPHENYL)-5-CHLORO-1-OXOPENTANE

SDS

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