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31952-16-6 | 2,2-Dibenzylpropane-1,3-diol
CAS No: 31952-16-6 Catalog No: AG003FA6 MDL No:
Product Description
Catalog Number:
AG003FA6
Chemical Name:
2,2-Dibenzylpropane-1,3-diol
CAS Number:
31952-16-6
Molecular Formula:
C17H20O2
Molecular Weight:
256.3395
IUPAC Name:
2,2-dibenzylpropane-1,3-diol
InChI:
InChI=1S/C17H20O2/c18-13-17(14-19,11-15-7-3-1-4-8-15)12-16-9-5-2-6-10-16/h1-10,18-19H,11-14H2
InChI Key:
AZLRECYOMFCGTK-UHFFFAOYSA-N
SMILES:
OCC(Cc1ccccc1)(Cc1ccccc1)CO
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.146g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
256.345g/mol
Monoisotopic Mass:
256.146g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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