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Home > Indoles and Oxindole > 191331-69-8
191331-69-8 | 1H-Indole-5,7-diol
CAS No: 191331-69-8 Catalog No: AG002F6A MDL No:
Product Description
Catalog Number:
AG002F6A
Chemical Name:
1H-Indole-5,7-diol
CAS Number:
191331-69-8
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
IUPAC Name:
1H-indole-5,7-diol
InChI:
InChI=1S/C8H7NO2/c10-6-3-5-1-2-9-8(5)7(11)4-6/h1-4,9-11H
InChI Key:
QRHGHMHEMJURIB-UHFFFAOYSA-N
SMILES:
Oc1cc(O)c2c(c1)cc[nH]2
Properties
Complexity:
151
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
149.149g/mol
Monoisotopic Mass:
149.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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