(E)-2-(2-Methylpropylidene)hexanal

HCID 6366336

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Basic information

CAS: 93980-82-6
Standard SMILES: CCCC/C(C=O)=C\C(C)C
InChIKey: BCKIEFFJHXOMBQ-JXMROGBWSA-N
Molecular formula: C10H18O
Average molar mass: 154.25 g/mol
Monoisotopic mass: 154.13576519

Names & identifiers

Preferred name: (E)-2-(2-Methylpropylidene)hexanal
IUPAC: (2E)-2-(2-methylpropylidene)hexanal
English name: (E)-2-(2-methylpropylidene)hexanal
Molecular formula: C10H18O
Molecular weight: 154.24932

Names & synonyms

(E)-2-(2-Methylpropylidene)hexanal93980-82-6EINECS 301-062-4(2E)-2-(2-methylpropylidene)hexanalBCKIEFFJHXOMBQ-JXMROGBWSA-NDTXSID401281491Hexanal, 2-(2-methylpropylidene)-, (E)-NS000630062-[(E)-2-Methylpropylidene]hexanal

Database identifiers

CAS: 93980-82-6
PubChem CID: 6366336
DTXSID: DTXSID401281491
EC Number: 301-062-4
Nikkaji: J367.867I

Properties

Computed structural properties

XLogP: 3.2
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 5
Heavy atoms: 11
Formal charge: 0
Complexity: 134

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