| CAS Number | 923826-21-5 |
| Catalog Number | AG019K6A |
| Chemical Name | 5-(furan-2-amido)-3-methylthiophene-2-carboxylic acid |
| IUPAC Name | 5-(furan-2-carbonylamino)-3-methylthiophene-2-carboxylic acid |
| InChI | InChI=1S/C11H9NO4S/c1-6-5-8(17-9(6)11(14)15)12-10(13)7-3-2-4-16-7/h2-5H,1H3,(H,12,13)(H,14,15) |
| InChI Key | OQWORQBOYCRKGW-UHFFFAOYSA-N |
| MDL Number | MFCD08444473 |
| Molecular Formula | C11H9NO4S |
| Molecular Weight | 251.2585 |
| SMILES | CC1=C(C(O)=O)SC(NC(C2OC=CC=2)=O)=C1 |
| Synonyms | 5-(furan-2-amido)-3-methylthiophene-2-carboxylic acid,
5-(2-furoylamino)-3-methylthiophene-2-carboxylic acid,
923826-21-5,
AC1Q2GGQ,
CTK7F9693,
ZINC9596209,
SBB078311,
AKOS000264286,
MCULE-8969867240,
NE32466,
EN300-25692,
AB00758105-01,
Z220383448,
5-(2-furylcarbonylamino)-3-methylthiophene-2-carboxylic acid,
5-(furan-2-carboxamido)-3-methylthiophene-2-carboxylic acid,
|
| Complexity | 323 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 251.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.256g/mol |
| Monoisotopic Mass | 251.025g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 108A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number