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848652-06-2 | Benzene, 1,3-bis(1,1-dimethylethyl)-5-(1,1-dimethyl-2-phenylethyl)-
CAS No: 848652-06-2 Catalog No: AG004QN6 MDL No:
Product Description
Catalog Number:
AG004QN6
Chemical Name:
Benzene, 1,3-bis(1,1-dimethylethyl)-5-(1,1-dimethyl-2-phenylethyl)-
CAS Number:
848652-06-2
Molecular Formula:
C24H34
Molecular Weight:
322.5268
IUPAC Name:
1,3-ditert-butyl-5-(2-methyl-1-phenylpropan-2-yl)benzene
InChI:
InChI=1S/C24H34/c1-22(2,3)19-14-20(23(4,5)6)16-21(15-19)24(7,8)17-18-12-10-9-11-13-18/h9-16H,17H2,1-8H3
InChI Key:
HNZBXDQRTWEUOQ-UHFFFAOYSA-N
SMILES:
CC(c1cc(cc(c1)C(C)(C)C)C(C)(C)C)(Cc1ccccc1)C
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.266g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.536g/mol
Monoisotopic Mass:
322.266g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.4
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