Basic information
- CAS
59524-02-6- Standard SMILES
CC(C)(C)OC(=O)N[C@@H](CO)C(=O)OCc1ccccc1- InChIKey
BQADRZHPZVQGCW-LBPRGKRZSA-N- Molecular formula
- C15H21NO5
- Average molar mass
- 295.33 g/mol
- Monoisotopic mass
- 295.14197277
Names & identifiers
- Preferred name
- Boc-Ser-OBzl
- IUPAC
- benzyl (2S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
- English name
- Boc-Ser-OH
- Molecular formula
- C15H21NO5
- Molecular weight
- 295.33
Names & synonyms
Boc-Ser-OBzl59524-02-6DTXSID00427031RefChem:330063DTXCID00377865Boc-L-serine benzyl ester(S)-Benzyl 2-((tert-butoxycarbonyl)amino)-3-hydroxypropanoateMFCD00076983benzyl (2S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoateCS-W009975Benzyl (tert-butoxycarbonyl)-L-serinateM03322
Show more names
Boc-L-SerineN-BOC-L-SERINEBOC-L-SER-OHBOC-SERINEBOC-L-SERBoc-Ser-OHBOC-SERINE-OHBOC-SERINE-OBZL
N-alpha-t-Butyloxycarbonyl-L-serine benzyl esterSerine, N-[(1,1-dimethylethoxy)carbonyl]-, phenylmethyl ester(S)-2-tert-butoxycarbonylamino-3-hydroxy-propionic acid benzyl esterBoc-L-Ser-Obzlbenzyl (2S)-2-(tert-butoxycarbonylamino)-3-hydroxy-propanoateN-Boc-serine benzyl esterN-boc-l-serine benzyl esterSCHEMBL1561964
Database identifiers
- CAS
59524-02-6- PubChem CID
- 7018792
- DTXSID
DTXSID00427031
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 84.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 344
Physicochemical properties
- Melting point
- 91 °C · 91 °C (dec.)(lit.)
- Boiling point
- 458.8 · 458.8±40.0 °C(Predicted)
- Density
- 1.174 · 1.174±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- solubility
- DMSO (Slightly), Methanol (Slightly), Water (Slightly)
- pka
- 10.67 · 10.67±0.46(Predicted)
- form
- Powder
- color
- White
- Water Solubility
- Slightly soluble in water.
- InChIKey
- BQADRZHPZVQGCW-LBPRGKRZSA-N
- CAS DataBase Reference
- 59524 · 59524-02-6(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety data
- F
- 10
- wgk
- 3
- hs_code
- 2924297099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesIt is a pharmaceutical intermediate. It is involved in Mitsunobu Reactions.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
北京华美互利生物化工010-56205725 · [email protected]
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Related reactions
7 records
Compound notes
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