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3-nitroheptan-4-ol

3-nitroheptan-4-ol structure

CAS No:
5462-04-4
Formula:
C7H15NO3
Chemical Name:
3-nitroheptan-4-ol
Synonyms:
3-nitroheptan-4-ol;3-nitro-4-heptanol;5462-04-4;NSC17689;SCHEMBL6338975;DTXSID20280620;NSC-17689

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3-nitroheptan-4-ol Basic Attributes

Molecular Weight：

161.20 g/mol

Exact Mass：

161.10519334 g/mol

NSC Number：

17689

DSSTox ID：

DTXSID20280620

Characteristics

PSA：

66 Å²

Computed Properties

Molecular Weight:161.20
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:161.10519334
Monoisotopic Mass:161.10519334
Topological Polar Surface Area:66
Heavy Atom Count:11
Complexity:121
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-nitroheptan-4-ol

Basic Attributes
Characteristics
Computed Properties

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