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4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE

4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE structure

CAS No:
51533-65-4
Formula:
C15H17NO3
Chemical Name:
4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE
Synonyms:
4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE;1-(3,4-dimethoxyphenyl)-4-oxocyclohexanecarbonitrile

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4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE Basic Attributes

Molecular Weight：

259.303

Exact Mass：

259.121

DSSTox ID：

DTXSID00353720

Characteristics

PSA：

59.3

XLogP3：

1.5

Density：

1.16±0.1 g/cm3(Predicted)

Melting Point：

114-116 °C

Computed Properties

Molecular Weight:259.30
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:259.12084340
Monoisotopic Mass:259.12084340
Topological Polar Surface Area:59.3
Heavy Atom Count:19
Complexity:374
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE

Basic Attributes
Characteristics
Computed Properties

4-CYANO-4-(3,4-DIMETHOXYPHENYL)CYCLOHEXANONE

SDS

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