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918399-21-0 | 1,1'-Biphenyl, 4-butoxy-4'-[(1E)-6-methyl-1-hepten-1-yl]-
CAS No: 918399-21-0 Catalog No: AG006G47 MDL No:
Product Description
Catalog Number:
AG006G47
Chemical Name:
1,1'-Biphenyl, 4-butoxy-4'-[(1E)-6-methyl-1-hepten-1-yl]-
CAS Number:
918399-21-0
Molecular Formula:
C24H32O
Molecular Weight:
336.5103
IUPAC Name:
1-butoxy-4-[4-(6-methylhept-1-enyl)phenyl]benzene
InChI:
InChI=1S/C24H32O/c1-4-5-19-25-24-17-15-23(16-18-24)22-13-11-21(12-14-22)10-8-6-7-9-20(2)3/h8,10-18,20H,4-7,9,19H2,1-3H3
InChI Key:
ORXGEPAWEIWMQK-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)c1ccc(cc1)/C=C/CCCC(C)C
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.245g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.519g/mol
Monoisotopic Mass:
336.245g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
8.1
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