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1167056-37-2 | 1H-Pyrrolo[2,3-c]pyridine-3-carboxylic acid, 5-chloro-7-methyl-
CAS No: 1167056-37-2 Catalog No: AG000D35 MDL No:
Product Description
Catalog Number:
AG000D35
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine-3-carboxylic acid, 5-chloro-7-methyl-
CAS Number:
1167056-37-2
Molecular Formula:
C9H7ClN2O2
Molecular Weight:
210.6171
IUPAC Name:
5-chloro-7-methyl-1H-pyrrolo[2,3-c]pyridine-3-carboxylic acid
InChI:
InChI=1S/C9H7ClN2O2/c1-4-8-5(2-7(10)12-4)6(3-11-8)9(13)14/h2-3,11H,1H3,(H,13,14)
InChI Key:
MODIPQWDDVHKOM-UHFFFAOYSA-N
SMILES:
Clc1nc(C)c2c(c1)c(c[nH]2)C(=O)O
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.02g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.617g/mol
Monoisotopic Mass:
210.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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