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151319-83-4 | 1,3-Benzenediol, 4,6-bis[(4-hydroxyphenyl)methyl]-
CAS No: 151319-83-4 Catalog No: AG001NAC MDL No:
Product Description
Catalog Number:
AG001NAC
Chemical Name:
1,3-Benzenediol, 4,6-bis[(4-hydroxyphenyl)methyl]-
CAS Number:
151319-83-4
Molecular Formula:
C20H18O4
Molecular Weight:
322.3545
IUPAC Name:
4,6-bis[(4-hydroxyphenyl)methyl]benzene-1,3-diol
InChI:
InChI=1S/C20H18O4/c21-17-5-1-13(2-6-17)9-15-11-16(20(24)12-19(15)23)10-14-3-7-18(22)8-4-14/h1-8,11-12,21-24H,9-10H2
InChI Key:
KXNGHSFCHPSAOV-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c(cc1Cc1ccc(cc1)O)Cc1ccc(cc1)O
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.121g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
322.36g/mol
Monoisotopic Mass:
322.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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