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octane-1,4,7-triol

octane-1,4,7-triol structure

CAS No:
5432-79-1
Formula:
C8H18O3
Chemical Name:
octane-1,4,7-triol
Synonyms:
octane-1,4,7-triol;1,4,7-Octanetriol;5432-79-1;1,7-Octanetriol;NSC18520;SCHEMBL10401773;DTXSID90280753;NSC-18520

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octane-1,4,7-triol Basic Attributes

Molecular Weight：

162.23 g/mol

Exact Mass：

162.125594432 g/mol

NSC Number：

18520

DSSTox ID：

DTXSID90280753

Characteristics

PSA：

60.7 Å²

Computed Properties

Molecular Weight:162.23
XLogP3:0.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:162.125594432
Monoisotopic Mass:162.125594432
Topological Polar Surface Area:60.7
Heavy Atom Count:11
Complexity:85.4
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of octane-1,4,7-triol

Basic Attributes
Characteristics
Computed Properties

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