| CAS Number | 478920-83-1 |
| Catalog Number | AG00J3H0(AGN-PC-0OAQYC) |
| Chemical Name | 2-(Piperidin-1-yl)acetic acid hydrate |
| IUPAC Name | 2-piperidin-1-ylacetic acid;hydrate |
| InChI | InChI=1S/C7H13NO2.H2O/c9-7(10)6-8-4-2-1-3-5-8;/h1-6H2,(H,9,10);1H2 |
| InChI Key | PZUMIQBMSVIMDN-UHFFFAOYSA-N |
| MDL Number | MFCD07781088 |
| Molecular Formula | C7H15NO3 |
| Molecular Weight | 161.1989 |
| SMILES | O=C(O)CN1CCCCC1.[H]O[H] |
| Synonyms | 478920-83-1,
1-Piperidinylacetic acid hydrate,
2-(Piperidin-1-yl)acetic acid hydrate,
Piperidin-Acetat-Hydrat,
ZX-CM015003,
MFCD07781088,
AKOS027426875,
2-Piperidinylacetic acid hydrate,
|
| Complexity | 119 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.201g/mol |
| Monoisotopic Mass | 161.105g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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