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(1-Cyclohexen-1-ylmethyl)benzene

HCID 557233
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Basic information

CAS
4714-09-4
Standard SMILES
C1=C(Cc2ccccc2)CCCC1
InChIKey
CXMRFPAKDYKJJZ-UHFFFAOYSA-N
Molecular formula
C13H16
Average molar mass
172.27 g/mol
Monoisotopic mass
172.12520051

Names & identifiers

Preferred name
(1-Cyclohexen-1-ylmethyl)benzene
IUPAC
cyclohexen-1-ylmethylbenzene

Names & synonyms

(1-Cyclohexen-1-ylmethyl)benzeneBenzene, [(cyclohex-1-en-1-yl)methyl]-Benzyl-cyclohexen[(cyclohex-1-en-1-yl)methyl]benzene1-cyclohexenylphenylmethane1-cyclohexenyl-methyl-benzene4714-09-4SCHEMBL646883SCHEMBL1399903SCHEMBL27909324DTXSID00339605CXMRFPAKDYKJJZ-UHFFFAOYSA-N
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(1-Cyclohexen-1-ylmethyl)benzene #

Database identifiers

CAS
4714-09-4
PubChem CID
557233
DTXSID
DTXSID00339605
Nikkaji
J927.971G

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
13
Formal charge
0
Complexity
172

Experimental & physicochemical properties

SpringerMaterials PropertiesDensity

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