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119395-61-8 | Benzene, (2-cyclohexen-1-ylidenemethyl)-
CAS No: 119395-61-8 Catalog No: AG000IOM MDL No:
Product Description
Catalog Number:
AG000IOM
Chemical Name:
Benzene, (2-cyclohexen-1-ylidenemethyl)-
CAS Number:
119395-61-8
Molecular Formula:
C13H14
Molecular Weight:
170.2503
IUPAC Name:
cyclohex-2-en-1-ylidenemethylbenzene
InChI:
InChI=1S/C13H14/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1,3-5,7-9,11H,2,6,10H2
InChI Key:
PRVFHVVGYCCSTI-UHFFFAOYSA-N
SMILES:
C1CC=CC(=Cc2ccccc2)C1
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.11g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.255g/mol
Monoisotopic Mass:
170.11g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.8
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