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Home > Nitro Compounds > 23709-47-9
23709-47-9 | 3-Nitro-1H-pyrrolo[2,3-b]pyridine
CAS No: 23709-47-9 Catalog No: AG003JSV MDL No:MFCD08272225
Product Description
Catalog Number:
AG003JSV
Chemical Name:
3-Nitro-1H-pyrrolo[2,3-b]pyridine
CAS Number:
23709-47-9
Molecular Formula:
C7H5N3O2
Molecular Weight:
163.1335
MDL Number:
MFCD08272225
IUPAC Name:
3-nitro-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H5N3O2/c11-10(12)6-4-9-7-5(6)2-1-3-8-7/h1-4H,(H,8,9)
InChI Key:
DTLVPICXPRRMOQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c[nH]c2c1cccn2
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.136g/mol
Monoisotopic Mass:
163.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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