1H-​Pyrrolo[2,​3-​b]​pyridine-​2-​carboxylic acid,  5-​amino-​, methyl ester


Chemical Name: 1H-​Pyrrolo[2,​3-​b]​pyridine-​2-​carboxylic acid,  5-​amino-​, methyl ester
CAS Number: 952182-18-2
Product Number: AG00IIU6(AGN-PC-0WAKT4)
Synonyms:
MDL No:
Molecular Formula: C9H9N3O2
Molecular Weight: 191.1867

Identification/Properties


Computed Properties
Molecular Weight:
191.19g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
191.069g/mol
Monoisotopic Mass:
191.069g/mol
Topological Polar Surface Area:
81A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3259
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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