| CAS Number | 1131595-03-3 |
| Catalog Number | AG0095TY(AGN-PC-0WAL48) |
| Chemical Name | 1-((BENZYLOXY)CARBONYL)-3-AMINOPIPERIDINE-3-CARBOXYLIC ACID |
| IUPAC Name | 3-amino-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid |
| InChI | InChI=1S/C14H18N2O4/c15-14(12(17)18)7-4-8-16(10-14)13(19)20-9-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10,15H2,(H,17,18) |
| InChI Key | GLKIELGAKRNCPQ-UHFFFAOYSA-N |
| MDL Number | MFCD11110741 |
| Molecular Formula | C14H18N2O4 |
| Molecular Weight | 278.3037 |
| SMILES | NC1(CN(CCC1)C(=O)OCC1=CC=CC=C1)C(=O)O |
| Synonyms | 1131595-03-3,
1-CBZ-3-AMINO-PIPERIDINE-3-CARBOXYLIC ACID,
3-amino-1-((benzyloxy)carbonyl)piperidine-3-carboxylic acid,
1-((BENZYLOXY)CARBONYL)-3-AMINOPIPERIDINE-3-CARBOXYLIC ACID,
SCHEMBL18132120,
MFCD11110741,
AKOS015836909,
1-cbz-3-aminopiperidine-3-carboxylic acid,
TC-066315,
25177-85-9,
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| Complexity | 368 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.308g/mol |
| Monoisotopic Mass | 278.127g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 92.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number