| CAS Number | 1263083-01-7 |
| Catalog Number | AG01C2CG(AGN-PC-0WOLU0) |
| Chemical Name | ethyl 1H,4H,6H,7H-pyrano[4,3-b]pyrrole-2-carboxylate |
| IUPAC Name | ethyl 1,4,6,7-tetrahydropyrano[4,3-b]pyrrole-2-carboxylate |
| InChI | InChI=1S/C10H13NO3/c1-2-14-10(12)9-5-7-6-13-4-3-8(7)11-9/h5,11H,2-4,6H2,1H3 |
| InChI Key | IAKGAUXLXMOGDP-UHFFFAOYSA-N |
| MDL Number | MFCD24620798 |
| Molecular Formula | C10H13NO3 |
| Molecular Weight | 195.2151 |
| SMILES | CCOC(C1NC2=C(COCC2)C=1)=O |
| Synonyms | ethyl 1H,4H,6H,7H-pyrano[4,3-b]pyrrole-2-carboxylate,
1263083-01-7,
SCHEMBL10268198,
ZINC168663169,
|
| Complexity | 219 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 195.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 195.218g/mol |
| Monoisotopic Mass | 195.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number