| CAS Number | 923126-67-4 |
| Catalog Number | AG00GUCH(AGN-PC-0WO0FE) |
| Chemical Name | 5-cyclopropaneamido-3-methylthiophene-2-carboxylic acid |
| IUPAC Name | 5-(cyclopropanecarbonylamino)-3-methylthiophene-2-carboxylic acid |
| InChI | InChI=1S/C10H11NO3S/c1-5-4-7(15-8(5)10(13)14)11-9(12)6-2-3-6/h4,6H,2-3H2,1H3,(H,11,12)(H,13,14) |
| InChI Key | BSQHGBMJAGEZRL-UHFFFAOYSA-N |
| MDL Number | MFCD08444394 |
| Molecular Formula | C10H11NO3S |
| Molecular Weight | 225.2642 |
| SMILES | CC1=C(C(=O)O)SC(=C1)NC(=O)C2CC2 |
| Synonyms | 923126-67-4,
5-[(cyclopropylcarbonyl)amino]-3-methylthiophene-2-carboxylic acid,
5-cyclopropaneamido-3-methylthiophene-2-carboxylic acid,
5-(Cyclopropanecarboxamido)-3-methylthiophene-2-carboxylic acid,
CTK7F6166,
ZINC9646661,
SBB078305,
AKOS000264333,
MCULE-5036506409,
NE36862,
EN300-25515,
J-516586,
Z212062948,
5-(cyclopropylcarbonylamino)-3-methylthiophene-2-carboxylic acid,
AC1Q2GGR,
2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide,
|
| Complexity | 290 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.045964g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.27g/mol |
| Monoisotopic Mass | 225.045964g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 94.6Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number