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830345-63-6 | Benzene, [(3Z)-5,5-dimethyl-3-hexenyl]-
CAS No: 830345-63-6 Catalog No: AG005CP5 MDL No:
Product Description
Catalog Number:
AG005CP5
Chemical Name:
Benzene, [(3Z)-5,5-dimethyl-3-hexenyl]-
CAS Number:
830345-63-6
Molecular Formula:
C14H20
Molecular Weight:
188.3086
IUPAC Name:
5,5-dimethylhex-3-enylbenzene
InChI:
InChI=1S/C14H20/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,7,11H2,1-3H3
InChI Key:
CIJJDTUSNKELLA-UHFFFAOYSA-N
SMILES:
CC(/C=C\CCc1ccccc1)(C)C
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.157g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.314g/mol
Monoisotopic Mass:
188.157g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
4.8
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