| CAS Number | 146293-15-4 |
| Catalog Number | AG01DU5Q(AGN-PC-0O39QK) |
| Chemical Name | Butanoic acid, 3-amino-, ethyl ester, hydrochloride, (R)- |
| IUPAC Name | ethyl (3R)-3-aminobutanoate;hydrochloride |
| InChI | InChI=1S/C6H13NO2.ClH/c1-3-9-6(8)4-5(2)7;/h5H,3-4,7H2,1-2H3;1H/t5-;/m1./s1 |
| InChI Key | ISVBSAIYXBEVSI-NUBCRITNSA-N |
| MDL Number | MFCD01862143 |
| Molecular Formula | C6H14ClNO2 |
| Molecular Weight | 167.6339 |
| SMILES | Cl.N[C@@H](CC(=O)OCC)C |
| Synonyms | (R)-Ethyl 3-aminobutanoate hydrochloride,
146293-15-4,
(R)-3-Amino-butyric acid ethyl ester hydrochloride,
SCHEMBL14920670,
ISVBSAIYXBEVSI-NUBCRITNSA-N,
MFCD01862143,
(R)-3-Amino-butyric acid ethyl ester HCl,
A58189,
Butanoic acid, 3-amino-, ethyl ester, hydrochloride, (R)-,
|
| Complexity | 93.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.071g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.633g/mol |
| Monoisotopic Mass | 167.071g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number