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88243-02-1 | 1,3-Benzenediol, bis(phenylmethyl)-
CAS No: 88243-02-1 Catalog No: AG004CUB MDL No:
Product Description
Catalog Number:
AG004CUB
Chemical Name:
1,3-Benzenediol, bis(phenylmethyl)-
CAS Number:
88243-02-1
Molecular Formula:
C20H18O2
Molecular Weight:
290.3557
IUPAC Name:
2,4-dibenzylbenzene-1,3-diol
InChI:
InChI=1S/C20H18O2/c21-19-12-11-17(13-15-7-3-1-4-8-15)20(22)18(19)14-16-9-5-2-6-10-16/h1-12,21-22H,13-14H2
InChI Key:
ZASQHQANOCXQHH-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1Cc1ccccc1)O)Cc1ccccc1
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.131g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
290.362g/mol
Monoisotopic Mass:
290.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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