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16819-47-9 | Benzene, 1,1'-(1,4-dimethyl-1,3-butadiene-1,4-diyl)bis-
CAS No: 16819-47-9 Catalog No: AG001XWG MDL No:
Product Description
Catalog Number:
AG001XWG
Chemical Name:
Benzene, 1,1'-(1,4-dimethyl-1,3-butadiene-1,4-diyl)bis-
CAS Number:
16819-47-9
Molecular Formula:
C18H18
Molecular Weight:
234.3355
IUPAC Name:
5-phenylhexa-2,4-dien-2-ylbenzene
InChI:
InChI=1S/C18H18/c1-15(17-9-5-3-6-10-17)13-14-16(2)18-11-7-4-8-12-18/h3-14H,1-2H3
InChI Key:
GGZMJMQKUXVBCQ-UHFFFAOYSA-N
SMILES:
CC(=CC=C(c1ccccc1)C)c1ccccc1
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.141g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
234.342g/mol
Monoisotopic Mass:
234.141g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
6.1
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