| CAS Number | 115545-85-2 |
| Catalog Number | AG00HD0M(AGN-PC-0NYRGH) |
| Chemical Name | D-Cysteine, S-(triphenylmethyl)-, methyl ester |
| IUPAC Name | methyl (2S)-2-amino-3-tritylsulfanylpropanoate |
| InChI | InChI=1S/C23H23NO2S/c1-26-22(25)21(24)17-27-23(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21H,17,24H2,1H3/t21-/m1/s1 |
| InChI Key | DXUZZMIANHJYIU-OAQYLSRUSA-N |
| MDL Number | MFCD27578273 |
| Molecular Formula | C23H23NO2S |
| Molecular Weight | 377.4992 |
| SMILES | COC(=O)[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)N |
| Synonyms | 115545-85-2,
METHYL (2S)-2-AMINO-3-[(TRIPHENYLMETHYL)SULFANYL]PROPANOATE,
SCHEMBL12872399,
S-Trityl-D-cysteine methyl ester,
ZINC31959878,
D-Cysteine, S-(triphenylmethyl)-, methyl ester,
|
| Complexity | 406 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 377.145g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 377.502g/mol |
| Monoisotopic Mass | 377.145g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 77.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number