| CAS Number | 1140239-96-8 |
| Catalog Number | AG000ABQ(AGN-PC-0WBSLL) |
| Chemical Name | Methyl 1H-pyrazolo[4,3-c]pyridine-4-carboxylate |
| IUPAC Name | methyl 1H-pyrazolo[4,3-c]pyridine-4-carboxylate |
| InChI | InChI=1S/C8H7N3O2/c1-13-8(12)7-5-4-10-11-6(5)2-3-9-7/h2-4H,1H3,(H,10,11) |
| InChI Key | VWWRQOHUTDDIKQ-UHFFFAOYSA-N |
| MDL Number | MFCD11975121 |
| Molecular Formula | C8H7N3O2 |
| Molecular Weight | 177.1601 |
| SMILES | COC(=O)c1nccc2[nH]ncc12 |
| Synonyms | METHYL 1H-PYRAZOLO[4,3-C]PYRIDINE-4-CARBOXYLATE,
1140239-96-8,
SCHEMBL20745914,
MFCD11975121,
ZINC89220011,
AKOS025396100,
AKOS032949958,
FCH1142565,
PB34652,
KS-000006T9,
AK173656,
AS-50868,
CS-0049238,
Q-3527,
1h-pyrazolo[4,3-c]pyridine-4-carboxylic acid methyl ester,
1H-PYRAZOLO[4,3-C]PYRIDINE-4-CARBOXYLIC ACID, METHYL ESTER,
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| 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 | 0.7 |
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Certificate of Analysis
Lot Number