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1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one

1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one structure

CAS No:
1577-03-3
Formula:
C13H15ClO
Chemical Name:
1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one
Synonyms:
1-Penten-3-one,1-(4-chlorophenyl)-4,4-dimethyl-;1-Penten-3-one,1-(p-chlorophenyl)-4,4-dimethyl-;1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one;4-Chlorobenzalpinacolone;1,1-Dimethylethyl 4-chlorostyryl ketone;NSC 203322;NSC 636688;4,4-Dimethyl-1-(p-chlorophenyl)-1-penten-3-one;1-(4-Chlorophenyl)-4,4-dimethylpent-1-en-3-one
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one Basic Attributes

Molecular Weight：

222.71

Exact Mass：

222.71

EC Number：

437-220-5

HScode：

2914700090

Characteristics

PSA：

17.07000

XLogP3：

3.96840

Appearance：

Liquid

Density：

1.083±0.06 g/cm3(Predicted)

Melting Point：

85-85.5 °C

Boiling Point：

332.0±17.0 °C(Predicted)

Flash Point：

189.1ºC

Refractive Index：

1.55

Vapor Pressure：

0.00015mmHg at 25°C

Safety Information

Precautionary statement(s)：

P261, P272, P273, P280, P302+P352, P321, P333+P313, P363, P391, P501

Hazard Statements：

H317

Computed Properties

Molecular Weight:222.71
XLogP3:4.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:222.0811428
Monoisotopic Mass:222.0811428
Topological Polar Surface Area:17.1
Heavy Atom Count:15
Complexity:242
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one

Basic Attributes
Characteristics
Safety Information
Computed Properties
Latest News
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1-(4-Chlorophenyl)-4,4-dimethyl-1-penten-3-one

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