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Home > Nitro Compounds > 1190318-01-4
1190318-01-4 | 1H-Pyrrolo[2,3-b]pyridin-5-ol, 4-nitro-
CAS No: 1190318-01-4 Catalog No: AG000HRZ MDL No:
Product Description
Catalog Number:
AG000HRZ
Chemical Name:
1H-Pyrrolo[2,3-b]pyridin-5-ol, 4-nitro-
CAS Number:
1190318-01-4
Molecular Formula:
C7H5N3O3
Molecular Weight:
179.1329
IUPAC Name:
4-nitro-1H-pyrrolo[2,3-b]pyridin-5-ol
InChI:
InChI=1S/C7H5N3O3/c11-5-3-9-7-4(1-2-8-7)6(5)10(12)13/h1-3,11H,(H,8,9)
InChI Key:
NGWVNUXLIKFJBM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(O)cnc2c1cc[nH]2
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.135g/mol
Monoisotopic Mass:
179.033g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
94.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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