Home Carboxys 1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid

1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid

CAS No.:
1040682-84-5
Catalog Number:
AG0039SP
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
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Product Description
Catalog Number:
AG0039SP
Chemical Name:
1H-Pyrrolo[3,2-c]pyridine-4-carboxylic acid
CAS Number:
1040682-84-5
Molecular Formula:
C8H6N2O2
Molecular Weight:
162.1454
MDL Number:
MFCD09965904
IUPAC Name:
1H-pyrrolo[3,2-c]pyridine-4-carboxylic acid
InChI:
InChI=1S/C8H6N2O2/c11-8(12)7-5-1-3-9-6(5)2-4-10-7/h1-4,9H,(H,11,12)
InChI Key:
KDGNDVIFEUMRNO-UHFFFAOYSA-N
SMILES:
OC(=O)c1nccc2c1cc[nH]2
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
162.148g/mol
Monoisotopic Mass:
162.043g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties