| CAS Number | 1989659-81-5 |
| Catalog Number | AG01B6FB |
| Chemical Name | methyl 3-formyl-5,6,7,8-tetrahydroindolizine-1-carboxylate |
| IUPAC Name | methyl 3-formyl-5,6,7,8-tetrahydroindolizine-1-carboxylate |
| InChI | InChI=1S/C11H13NO3/c1-15-11(14)9-6-8(7-13)12-5-3-2-4-10(9)12/h6-7H,2-5H2,1H3 |
| InChI Key | LCDQQIKYNLTSNL-UHFFFAOYSA-N |
| MDL Number | MFCD30342820 |
| Molecular Formula | C11H13NO3 |
| Molecular Weight | 207.2258 |
| SMILES | COC(C1=C2N(CCCC2)C(C=O)=C1)=O |
| Synonyms | methyl 3-formyl-5,6,7,8-tetrahydroindolizine-1-carboxylate,
1989659-81-5,
ZINC521399050,
|
| Complexity | 267 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.229g/mol |
| Monoisotopic Mass | 207.09g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 48.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number