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1301214-72-1 | 1H-Pyrazolo[4,3-b]pyridine-6-carboxylic acid, methyl ester
CAS No: 1301214-72-1 Catalog No: AG000U0Z MDL No:MFCD20923321
Product Description
Catalog Number:
AG000U0Z
Chemical Name:
1H-Pyrazolo[4,3-b]pyridine-6-carboxylic acid, methyl ester
CAS Number:
1301214-72-1
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD20923321
IUPAC Name:
methyl 1H-pyrazolo[4,3-b]pyridine-6-carboxylate
InChI:
InChI=1S/C8H7N3O2/c1-13-8(12)5-2-6-7(9-3-5)4-10-11-6/h2-4H,1H3,(H,10,11)
InChI Key:
AQDFNXASXNIENA-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnc2c(c1)[nH]nc2
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.163g/mol
Monoisotopic Mass:
177.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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