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1190309-92-2 | 1H-Pyrrolo[2,3-b]pyridine, 6-chloro-3-nitro-
CAS No: 1190309-92-2 Catalog No: AG000P46 MDL No:MFCD12962921
Product Description
Catalog Number:
AG000P46
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 6-chloro-3-nitro-
CAS Number:
1190309-92-2
Molecular Formula:
C7H4ClN3O2
Molecular Weight:
197.5786
MDL Number:
MFCD12962921
IUPAC Name:
6-chloro-3-nitro-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H4ClN3O2/c8-6-2-1-4-5(11(12)13)3-9-7(4)10-6/h1-3H,(H,9,10)
InChI Key:
LHSQYXDNGXWWTK-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)[nH]cc2[N+](=O)[O-]
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.999g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.578g/mol
Monoisotopic Mass:
196.999g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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