| CAS Number | 16959-59-4 |
| Catalog Number | AG01C4I5(AGN-PC-0C6FNR) |
| Chemical Name | 5,6,7,8-Tetrahydroindolizine-2-carboxylic acid |
| IUPAC Name | 5,6,7,8-tetrahydroindolizine-2-carboxylic acid |
| InChI | InChI=1S/C9H11NO2/c11-9(12)7-5-8-3-1-2-4-10(8)6-7/h5-6H,1-4H2,(H,11,12) |
| InChI Key | VNKYAVPURGSAQN-UHFFFAOYSA-N |
| MDL Number | MFCD20542923 |
| Molecular Formula | C9H11NO2 |
| Molecular Weight | 165.1891 |
| SMILES | C=1C(=CN2CCCCC12)C(=O)O |
| Synonyms | 5,6,7,8-tetrahydroindolizine-2-carboxylic acid,
16959-59-4,
SCHEMBL1393022,
VNKYAVPURGSAQN-UHFFFAOYSA-N,
ZINC88189918,
AKOS022906784,
2-Indolizinecarboxylic acid, 5,6,7,8-tetrahydro-,
F2147-3728,
Z2380439813,
5,6,7,8-tetrahydro-indolizine-2-carboxylic acid,
|
| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.192g/mol |
| Monoisotopic Mass | 165.079g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number