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247940-08-5 | 1,1'-Biphenyl, 4'-(1,1-dimethylethyl)-2-methyl-
CAS No: 247940-08-5 Catalog No: AG002PGG MDL No:
Product Description
Catalog Number:
AG002PGG
Chemical Name:
1,1'-Biphenyl, 4'-(1,1-dimethylethyl)-2-methyl-
CAS Number:
247940-08-5
Molecular Formula:
C17H20
Molecular Weight:
224.3407
IUPAC Name:
1-tert-butyl-4-(2-methylphenyl)benzene
InChI:
InChI=1S/C17H20/c1-13-7-5-6-8-16(13)14-9-11-15(12-10-14)17(2,3)4/h5-12H,1-4H3
InChI Key:
RWAGEVSYASTPFD-UHFFFAOYSA-N
SMILES:
Cc1ccccc1c1ccc(cc1)C(C)(C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.157g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.347g/mol
Monoisotopic Mass:
224.157g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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