 Home > Encyclopedia > 1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone

1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone

1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone structure

CAS No:
7404-76-4
Formula:
C20H32N2O8
Chemical Name:
1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone
Synonyms:
7404-76-4;NSC403122;DTXSID10323131;NSC-403122;1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone

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1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone Basic Attributes

Molecular Weight：

428.5 g/mol

Exact Mass：

428.21586598 g/mol

NSC Number：

403122

DSSTox ID：

DTXSID10323131

Characteristics

PSA：

166 Å²

Computed Properties

Molecular Weight:428.5
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:428.21586598
Monoisotopic Mass:428.21586598
Topological Polar Surface Area:166
Heavy Atom Count:30
Complexity:684
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[5-[2-(3-acetyl-4-hydroxy-4-methyl-1-nitrocyclohexyl)ethyl]-2-hydroxy-2-methyl-5-nitrocyclohexyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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