| CAS Number | 1044637-65-1 |
| Catalog Number | AG00HACS(AGN-PC-0WC2KX) |
| Chemical Name | 1-cyclopentanecarbonylpiperidine-2-carboxylic acid |
| IUPAC Name | 1-(cyclopentanecarbonyl)piperidine-2-carboxylic acid |
| InChI | InChI=1S/C12H19NO3/c14-11(9-5-1-2-6-9)13-8-4-3-7-10(13)12(15)16/h9-10H,1-8H2,(H,15,16) |
| InChI Key | BHNIPDIWMSLFOZ-UHFFFAOYSA-N |
| MDL Number | MFCD28404698 |
| Molecular Formula | C12H19NO3 |
| Molecular Weight | 225.2842 |
| SMILES | OC(C1N(C(C2CCCC2)=O)CCCC1)=O |
| Synonyms | 1-(CYCLOPENTYLCARBONYL)PIPERIDINE-2-CARBOXYLIC ACID,
1044637-65-1,
1-cyclopentanecarbonylpiperidine-2-carboxylic acid,
1-(Cyclopentanecarbonyl)piperidine-2-carboxylic acid,
1-(Cyclopentylcarbonyl)-2-piperidine-carboxylic acid,
AC1Q74GM,
SCHEMBL3709107,
CTK7G3213,
ALBB-029744,
MFCD08445234,
AKOS000126642,
AKOS017272453,
MCULE-3791861121,
NE54669,
TR-066306,
EN300-71903,
2-piperidinecarboxylic acid, 1-(cyclopentylcarbonyl)-,
Z85896005,
|
| Complexity | 284 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 225.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 225.288g/mol |
| Monoisotopic Mass | 225.136g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number