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2,3-Pinanediol

2,3-Pinanediol structure

CAS No:
53404-49-2
Formula:
C10H18O2
Chemical Name:
2,3-Pinanediol
Synonyms:
Bicyclo[3.1.1]heptane-2,3-diol,2,6,6-trimethyl-;2,3-Pinanediol;2,6,6-Trimethylbicyclo[3.1.1]heptane-2,3-diol;NSC 71454;2,6,6-Trimethyl-bicyclo[3.1.1]heptan-2,3-diol

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2,3-Pinanediol Basic Attributes

Molecular Weight：

170.25 g/mol

Exact Mass：

170.25

UNII：

0YBA7G0JSH

NSC Number：

71454

DSSTox ID：

DTXSID3041326

Characteristics

PSA：

40.5 Å²

Melting Point：

170.5 °C @ Solvent: Chloroform

Drug Information

MeSH Entry Terms：

2,3-cis-pinanediol

Computed Properties

Molecular Weight:170.25
XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Exact Mass:170.130679813
Monoisotopic Mass:170.130679813
Topological Polar Surface Area:40.5
Heavy Atom Count:12
Complexity:212
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,3-Pinanediol

Basic Attributes
Characteristics
Drug Information
Computed Properties

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