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1-(4-Chlorophenyl)1,3-butanedione

1-(4-Chlorophenyl)1,3-butanedione structure

CAS No:
6302-55-2
Formula:
C10H9ClO2
Chemical Name:
1-(4-Chlorophenyl)1,3-butanedione
Synonyms:
1-(4-chlorophenyl)butane-1,3-dione;1-(4-Chlorophenyl)1,3-butanedione;1-(4-chlorophenyl)-1,3-butanedione;1,3-Butanedione, 1-(4-chlorophenyl)-;p-Chlorbenzoylaceton;4-Chlorobenzoylacetone;p-chloro-benzoylacetone;ACMC-1B4UU;SCHEMBL908578;CTK5B7150
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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1-(4-Chlorophenyl)1,3-butanedione Basic Attributes

Molecular Weight：

196.630

Exact Mass：

196.029114

NSC Number：

42232

DSSTox ID：

DTXSID20285554

HScode：

2914700090

Characteristics

PSA：

34.14000

XLogP3：

3.20

Density：

1.2±0.1 g/cm3

Melting Point：

73-74 °C

Boiling Point：

312.0±17.0 °C at 760 mmHg

Flash Point：

131.1±21.5 °C

Refractive Index：

1.531

Computed Properties

Molecular Weight:196.63
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:196.0291072
Monoisotopic Mass:196.0291072
Topological Polar Surface Area:34.1
Heavy Atom Count:13
Complexity:205
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-(4-chlorophenyl)butane-1,3-dione

CAS No.: 6302-55-2

Content: 99.00%

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Guide of 1-(4-Chlorophenyl)1,3-butanedione

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