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27694-86-6 | Benzene, 1,2-octadien-1-yl-
CAS No: 27694-86-6 Catalog No: AG002UI0 MDL No:
Product Description
Catalog Number:
AG002UI0
Chemical Name:
Benzene, 1,2-octadien-1-yl-
CAS Number:
27694-86-6
Molecular Formula:
C14H18
Molecular Weight:
186.2927
IUPAC Name:
octa-1,2-dienylbenzene
InChI:
InChI=1S/C14H18/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14/h6-7,9-13H,2-5H2,1H3
InChI Key:
BPJFBJDNTJGZEP-UHFFFAOYSA-N
SMILES:
CCCCCC=C=Cc1ccccc1
Properties
Complexity:
178
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.141g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.298g/mol
Monoisotopic Mass:
186.141g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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