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CID 36308

HCID 36308
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Basic information

CAS
33046-81-0
Standard SMILES
CC(=O)C=CCCC(C)C
InChIKey
QFSMRIFNMXHJQK-UHFFFAOYSA-N
Molecular formula
C9H16O
Average molar mass
140.22 g/mol
Monoisotopic mass
140.12011513

Names & identifiers

Preferred name
CID 36308
IUPAC
7-methyloct-3-en-2-one

Names & synonyms

SCHEMBL1783406NS00060314

Database identifiers

CAS
33046-81-0
PubChem CID
36308

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
10
Formal charge
0
Complexity
123

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