4-Methyl-3,4,5,6,7,8-hexahydro-2h-chromene

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Basic information

CAS: 16121-01-0
Standard SMILES: CC1CCOC2=C1CCCC2
InChIKey: UBUSSJKWRLWFOA-UHFFFAOYSA-N
Molecular formula: C10H16O
Average molar mass: 152.23 g/mol
Monoisotopic mass: 152.12011513

Names & identifiers

Preferred name: 4-Methyl-3,4,5,6,7,8-hexahydro-2h-chromene
IUPAC: 4-methyl-3,4,5,6,7,8-hexahydro-2H-chromene

Names & synonyms

16121-01-04-methyl-3,4,5,6,7,8-hexahydro-2h-chromeneNSC1060912H-1-Benzopyran,3,4,5,6,7,8-hexahydro-4-methyl-DTXSID90295887NSC-106091DS-0132694-METHYL-3,4,5,6,7,8-HEXAHYDRO-2H-1-BENZOPYRAN

Database identifiers

CAS: 16121-01-0
PubChem CID: 266995
DTXSID: DTXSID90295887

Properties

Computed structural properties

XLogP: 2.2
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 181

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Compound notes

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