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122444-76-2 | Benzene, (4-methyl-1-methylene-2,3-pentadien-1-yl)-
CAS No: 122444-76-2 Catalog No: AG00178Q MDL No:
Product Description
Catalog Number:
AG00178Q
Chemical Name:
Benzene, (4-methyl-1-methylene-2,3-pentadien-1-yl)-
CAS Number:
122444-76-2
Molecular Formula:
C13H14
Molecular Weight:
170.2503
IUPAC Name:
5-methylhexa-1,3,4-trien-2-ylbenzene
InChI:
InChI=1S/C13H14/c1-11(2)9-10-12(3)13-7-5-4-6-8-13/h4-8,10H,3H2,1-2H3
InChI Key:
SYVCWRIGLNRENL-UHFFFAOYSA-N
SMILES:
C=C(c1ccccc1)C=C=C(C)C
Properties
Complexity:
229
Compound Is Canonicalized:
No
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:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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