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5-CYANO-1,3-DIHYDROXYMETHYLBENZENE

5-CYANO-1,3-DIHYDROXYMETHYLBENZENE structure

CAS No:
146335-23-1
Formula:
C9H9NO2
Chemical Name:
5-CYANO-1,3-DIHYDROXYMETHYLBENZENE
Synonyms:
5-CYANO-1,3-DIHYDROXYMETHYLBENZENE;3,5-bis(hydroxymethyl)Benzonitrile

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5-CYANO-1,3-DIHYDROXYMETHYLBENZENE Basic Attributes

Molecular Weight：

163.17326

Exact Mass：

163.063

DSSTox ID：

DTXSID90576769

Characteristics

PSA：

64.2

XLogP3：

-0.1

Density：

1.27±0.1 g/cm3(Predicted)

Boiling Point：

372.9±32.0 °C(Predicted)

Computed Properties

Molecular Weight:163.17
XLogP3:-0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:163.063328530
Monoisotopic Mass:163.063328530
Topological Polar Surface Area:64.2
Heavy Atom Count:12
Complexity:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-CYANO-1,3-DIHYDROXYMETHYLBENZENE

Basic Attributes
Characteristics
Computed Properties

5-CYANO-1,3-DIHYDROXYMETHYLBENZENE

SDS

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