| CAS Number | 801162-35-6 |
| Catalog Number | AG00GL5O(AGN-PC-0UGF4P) |
| Chemical Name | (S)-Methyl 2-Amino-2-Cyclopentylacetate |
| IUPAC Name | methyl (2S)-2-amino-2-cyclopentylacetate |
| InChI | InChI=1S/C8H15NO2/c1-11-8(10)7(9)6-4-2-3-5-6/h6-7H,2-5,9H2,1H3/t7-/m0/s1 |
| InChI Key | ZGQSMYWOPKCARZ-ZETCQYMHSA-N |
| MDL Number | MFCD20617284 |
| Molecular Formula | C8H15NO2 |
| Molecular Weight | 157.2102 |
| SMILES | COC([C@@H](N)C1CCCC1)=O |
| Synonyms | (S)-METHYL 2-AMINO-2-CYCLOPENTYLACETATE,
801162-35-6,
SCHEMBL12723953,
MFCD20617284,
ZINC16698104,
Methyl (2S)-amino(cyclopentyl)ethanoate,
AJ-69468,
METHYL (2S)-2-AMINO-2-CYCLOPENTYLACETATE,
Cyclopentaneacetic acid, a-aMino-, Methyl ester, (aS)-,
cyclopentylglycine methyl ester,
2521-84-8,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 157.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 157.213g/mol |
| Monoisotopic Mass | 157.11g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number