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122135-80-2 | 1,2-Ethanediol, 1,1-bis(4-methylphenyl)-2-phenyl-
CAS No: 122135-80-2 Catalog No: AG0016U5 MDL No:
Product Description
Catalog Number:
AG0016U5
Chemical Name:
1,2-Ethanediol, 1,1-bis(4-methylphenyl)-2-phenyl-
CAS Number:
122135-80-2
Molecular Formula:
C22H22O2
Molecular Weight:
318.4089
IUPAC Name:
1,1-bis(4-methylphenyl)-2-phenylethane-1,2-diol
InChI:
InChI=1S/C22H22O2/c1-16-8-12-19(13-9-16)22(24,20-14-10-17(2)11-15-20)21(23)18-6-4-3-5-7-18/h3-15,21,23-24H,1-2H3
InChI Key:
DJENFIFQSSNDSL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(C(c1ccccc1)O)(c1ccc(cc1)C)O
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.162g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
318.416g/mol
Monoisotopic Mass:
318.162g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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