| CAS Number | 350230-37-4 |
| Catalog Number | AG01FS4J(AGN-PC-3H5PP3) |
| Chemical Name | (R)-2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid hydrate |
| IUPAC Name | 3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid;hydrate |
| InChI | InChI=1S/C8H15NO5.H2O/c1-8(2,3)14-7(13)9-5(4-10)6(11)12;/h5,10H,4H2,1-3H3,(H,9,13)(H,11,12);1H2 |
| InChI Key | JLIWGTMHYWJUPM-UHFFFAOYSA-N |
| MDL Number | MFCD26792600 |
| Molecular Formula | C8H17NO6 |
| Molecular Weight | 223.2237 |
| SMILES | O.C(C)(C)(C)OC(=O)N[C@@H](C(=O)O)CO |
| Synonyms | BOC-DL-Serine hydrate,
N-Boc-L-serine Hydrate,
2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid hydrate,
(R)-2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid hydrate,
350230-37-4,
CTK8A1370,
AKOS026742151,
SY047768,
DB-045211,
AK00783114,
MFCD00150501 (98%),
EN300-130994,
(2S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid,hydrate;Boc-Ser-OH.H2O,
Boc-Ser-OH,
BOC-L-Serine hydrate,
204191-40-2,
(S)-2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid hydrate,
N/A,
(2S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid;hydrate,
3262-72-4,
|
| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.105587g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.22g/mol |
| Monoisotopic Mass | 223.105587g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 96.9Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number