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13102-23-3 | 1,1':2',1''-Terphenyl, 3',6'-dimethyl-
CAS No: 13102-23-3 Catalog No: AG000VCR MDL No:
Product Description
Catalog Number:
AG000VCR
Chemical Name:
1,1':2',1''-Terphenyl, 3',6'-dimethyl-
CAS Number:
13102-23-3
Molecular Formula:
C20H18
Molecular Weight:
258.3569
IUPAC Name:
1,4-dimethyl-2,3-diphenylbenzene
InChI:
InChI=1S/C20H18/c1-15-13-14-16(2)20(18-11-7-4-8-12-18)19(15)17-9-5-3-6-10-17/h3-14H,1-2H3
InChI Key:
DWRQIROFOIDAOI-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1c1ccccc1)c1ccccc1)C
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.141g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.364g/mol
Monoisotopic Mass:
258.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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