| CAS Number | 86236-37-5 |
| Catalog Number | AG00GVZS(AGN-PC-00N5HF) |
| Chemical Name | thieno[3,2-c]pyridine-2-carboxylic acid |
| IUPAC Name | thieno[3,2-c]pyridine-2-carboxylic acid |
| InChI | InChI=1S/C8H5NO2S/c10-8(11)7-3-5-4-9-2-1-6(5)12-7/h1-4H,(H,10,11) |
| InChI Key | VKOINCMQZKBKHH-UHFFFAOYSA-N |
| MDL Number | MFCD16658570 |
| Molecular Formula | C8H5NO2S |
| Molecular Weight | 179.1958 |
| SMILES | OC(=O)c1cc2c(s1)ccnc2 |
| Synonyms | THIENO[3,2-C]PYRIDINE-2-CARBOXYLIC ACID,
86236-37-5,
SCHEMBL844056,
DTXSID70544264,
VKOINCMQZKBKHH-UHFFFAOYSA-N,
MFCD16658570,
ZINC34099325,
AKOS022640229,
CM10782,
AS-41637,
CS-0082386,
C-0379,
thieno[3,2-c]pyridine-2-carboxylic acid, 95% - 1G 1g,
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| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.004g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.193g/mol |
| Monoisotopic Mass | 179.004g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 78.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
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Certificate of Analysis
Lot Number