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132560-69-1 | Benzene, (1-ethenyl-1,5-dimethyl-4-hexen-1-yl)-
CAS No: 132560-69-1 Catalog No: AG0010TV MDL No:
Product Description
Catalog Number:
AG0010TV
Chemical Name:
Benzene, (1-ethenyl-1,5-dimethyl-4-hexen-1-yl)-
CAS Number:
132560-69-1
Molecular Formula:
C16H22
Molecular Weight:
214.3459
IUPAC Name:
3,7-dimethylocta-1,6-dien-3-ylbenzene
InChI:
InChI=1S/C16H22/c1-5-16(4,13-9-10-14(2)3)15-11-7-6-8-12-15/h5-8,10-12H,1,9,13H2,2-4H3
InChI Key:
NHMUKDSFOSGYPA-UHFFFAOYSA-N
SMILES:
C=CC(c1ccccc1)(CCC=C(C)C)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.172g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.352g/mol
Monoisotopic Mass:
214.172g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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