3,7-dimethyloct-6-enyl N-phenylcarbamate

HCID 348971

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Basic information

CAS: 16930-36-2
Standard SMILES: CC(C)=CCCC(C)CCOC(=O)Nc1ccccc1
InChIKey: JOIZZGCSCGBVKP-UHFFFAOYSA-N
Molecular formula: C17H25NO2
Average molar mass: 275.4 g/mol
Monoisotopic mass: 275.18852904

Names & identifiers

Preferred name: 3,7-dimethyloct-6-enyl N-phenylcarbamate
IUPAC: 3,7-dimethyloct-6-enyl N-phenylcarbamate

Names & synonyms

3,7-dimethyloct-6-enyl N-phenylcarbamate16930-36-2DTXSID50325073RefChem:272621DTXCID30276190NSC408510citronellyl N-phenylcarbamateNSC-4085103,7-Dimethyloct-6-en-1-yl phenylcarbamateDS-0059476-Octen-1-ol,3,7-dimethyl-, 1-(n-phenylcarbamate)

Database identifiers

CAS: 16930-36-2
PubChem CID: 348971
DTXSID: DTXSID50325073

Properties

Computed structural properties

XLogP: 5.6
Topological polar surface area: 38.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 8
Heavy atoms: 20
Formal charge: 0
Complexity: 302

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