1-(1,2,3,4,5,6,7,8-Octahydro-3,3,8,8-tetramethyl-2-naphthalenyl)ethanone

HCID 95600

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 94201-32-8
Standard SMILES: CC(=O)C1CC2=C(CCCC2(C)C)CC1(C)C
InChIKey: SDEONVHJAQRLCH-UHFFFAOYSA-N
Molecular formula: C16H26O
Average molar mass: 234.38 g/mol
Monoisotopic mass: 234.19836545

Names & identifiers

Preferred name: 1-(1,2,3,4,5,6,7,8-Octahydro-3,3,8,8-tetramethyl-2-naphthalenyl)ethanone
IUPAC: 1-(3,3,8,8-tetramethyl-1,2,4,5,6,7-hexahydronaphthalen-2-yl)ethanone
English name: 1-(1,2,3,4,5,6,7,8-octahydro-3,3,8,8-tetramethyl-2-naphthyl)ethan-1-one
Molecular formula: C16H26O
Molecular weight: 234.37704

Names & synonyms

94201-32-81-(1,2,3,4,5,6,7,8-Octahydro-3,3,8,8-tetramethyl-2-naphthyl)ethan-1-oneDTXSID3011498941-(1,2,3,4,5,6,7,8-Octahydro-3,3,8,8-tetramethyl-2-naphthalenyl)ethanoneRefChem:1053695DTXCID301581452303-617-61-(3,3,8,8-tetramethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-2-yl)ethanoneNSC22303EINECS 303-617-6SDEONVHJAQRLCH-UHFFFAOYSA-NNSC 22303

Show more names

1-[(1,2,3,4,5,6,7,8-Octahydro-3,3,8,8-tetramethylnaphthalen)-2-yl]ethanone

NSC-223031-(3,3,8,8-tetramethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-2-yl)ethan-1-oneNS00066238

Database identifiers

CAS: 94201-32-8
PubChem CID: 95600
DTXSID: DTXSID301149894
EC Number: 303-617-6
Nikkaji: J382.435G

Properties

Computed structural properties

XLogP: 3.6
Topological polar surface area: 17.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 17
Formal charge: 0
Complexity: 371

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…