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163463-62-5 | 2,3-Benzofurandiol
CAS No: 163463-62-5 Catalog No: AG001U4R MDL No:
Product Description
Catalog Number:
AG001U4R
Chemical Name:
2,3-Benzofurandiol
CAS Number:
163463-62-5
Molecular Formula:
C8H6O3
Molecular Weight:
150.1314
IUPAC Name:
1-benzofuran-2,3-diol
InChI:
InChI=1S/C8H6O3/c9-7-5-3-1-2-4-6(5)11-8(7)10/h1-4,9-10H
InChI Key:
DNDWXJDUTDZBNV-UHFFFAOYSA-N
SMILES:
Oc1c(O)oc2c1cccc2
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.032g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
150.133g/mol
Monoisotopic Mass:
150.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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