| CAS Number | 1272755-12-0 |
| Catalog Number | AG009C3G(AGN-PC-0WBO9R) |
| Chemical Name | Bzl-D-met-ome hcl |
| IUPAC Name | methyl (2R)-2-(benzylamino)-4-methylsulfanylbutanoate;hydrochloride |
| InChI | InChI=1S/C13H19NO2S.ClH/c1-16-13(15)12(8-9-17-2)14-10-11-6-4-3-5-7-11;/h3-7,12,14H,8-10H2,1-2H3;1H/t12-;/m1./s1 |
| InChI Key | PELBNOHMQZOBAL-UTONKHPSSA-N |
| MDL Number | MFCD04973105 |
| Molecular Formula | C13H20ClNO2S |
| Molecular Weight | 289.8214 |
| SMILES | Cl.COC(=O)[C@@H](CCSC)NCC1=CC=CC=C1 |
| Synonyms | BZL-D-MET-OME HCL,
1272755-12-0,
(R)-Methyl 2-(benzylamino)-4-(methylthio)butanoate hydrochloride,
C13H19NO2S.HCl,
CTK6I6216,
6487AH,
MFCD04973105,
AS-46813,
K-3959,
BENZYL-D-METHIONINE METHYLESTER HYDROCHLORIDE,
N-alpha-Benzyl-D-methionine methyl ester hydrochlorid,
(S)-Methyl 2-(benzylamino)-4-(methylthio)butanoate hydrochloride,
402929-60-6,
|
| Complexity | 218 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 289.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 289.818g/mol |
| Monoisotopic Mass | 289.09g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 63.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number