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133358-62-0 | 1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)-
CAS No: 133358-62-0 Catalog No: AG0014QL MDL No:
Product Description
Catalog Number:
AG0014QL
Chemical Name:
1,1':4',1''-Terphenyl, 4-(1,1-dimethylethyl)-
CAS Number:
133358-62-0
Molecular Formula:
C22H22
Molecular Weight:
286.4101
IUPAC Name:
1-tert-butyl-4-(4-phenylphenyl)benzene
InChI:
InChI=1S/C22H22/c1-22(2,3)21-15-13-20(14-16-21)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-16H,1-3H3
InChI Key:
IAHHHZBPQZNCFG-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)c1ccc(cc1)c1ccccc1)(C)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.172g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.418g/mol
Monoisotopic Mass:
286.172g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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