Hexadeca-6,11-dienal

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Basic information

CAS: 58701-06-7
Standard SMILES: CCCCC=CCCCC=CCCCCC=O
InChIKey: UVAAPIIWFSOFFC-UHFFFAOYSA-N
Molecular formula: C16H28O
Average molar mass: 236.39 g/mol
Monoisotopic mass: 236.21401551

Names & identifiers

Preferred name: Hexadeca-6,11-dienal
IUPAC: hexadeca-6,11-dienal
English name: (6E,11Z)-6,11-Hexadecadienal
Molecular formula: C16H28O
Molecular weight: 236.39

Names & synonyms

Hexadeca-6,11-dienal58701-06-7DTXSID80710918RefChem:347417DTXCID90661664SCHEMBL1301368(E,Z)-6,11-Hexadecadienal(6E,11Z)-6,11-Hexadecadienal6,11-Hexadecadienal, (6E,11Z)-

Database identifiers

CAS: 58701-06-7
PubChem CID: 54373706
DTXSID: DTXSID80710918

Properties

Computed structural properties

XLogP: 5.2
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 12
Heavy atoms: 17
Formal charge: 0
Complexity: 204

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