Basic information
- CAS
3560-17-6- Standard SMILES
CC(C)(C)OC(=O)N[C@@H](CSCc1ccccc1)C(=O)Oc1ccc([N+](=O)[O-])cc1- InChIKey
DEQZTANESNRFKU-SFHVURJKSA-N- Molecular formula
- C21H24N2O6S
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.13550749
Names & identifiers
- Preferred name
- p-Nitrophenyl S-benzyl-N-(tert-butoxycarbonyl)-L-cysteinate
- IUPAC
- (4-nitrophenyl) (2R)-3-benzylsulfanyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
- English name
- Boc-Cys(Bzl)-ONp
- Molecular formula
- C21H24N2O6S
- Molecular weight
- 432.49
Names & synonyms
3560-17-64-nitrophenyl s-benzyl-n-(tert-butoxycarbonyl)-l-cysteinateEINECS 222-622-3DEQZTANESNRFKU-SFHVURJKSA-NDTXSID601134228p-Nitrophenyl S-benzyl-N-(tert-butoxycarbonyl)-L-cysteinateNSC 164042N-[(1,1-Dimethylethoxy)carbonyl]-S-(phenylmethyl)-L-cysteine 4-nitrophenyl esterNS00049784N-t-butoxycarbonyl-S-benzylcysteine p-nitrophenyl esterBoc-Cys(Bzl)-ONpBOC-CYSTEINE(BZL)-ONP
Show more names
BOC-S-BENZYL-L-CYSTEINE P-NITROPHENYL ESTERBOC-S-BENZYL-L-CYSTEINE 4-NITROPHENYL ESTERN-(tert-butoxycarbonyl)-S-benzyl-L-cysteine 4-nitrophenylN-tert-butoxycarbonyl-S-benzylcysteine p-nitrophenyl ester(R)-4-Nitrophenyl 3-(benzylthio)-2-((tert-butoxycarbonyl)amino)propanoate4-nitrophenyl (2R)-3-(benzylsulfanyl)-2-{[(tert-butoxy)carbonyl]amino}propanoate
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 575
Physicochemical properties
- Boiling point
- 608.5 · 608.5±55.0 °C(Predicted)
- Density
- 1.265 · 1.265±0.06 g/cm3(Predicted)
- storage temp.
- -15 °C · -15°C
- pka
- 10.48 · 10.48±0.46(Predicted)
Chemistry & industry
Suppliers8 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
陕西缔都医药有限责任公司81148925 17391631969 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
山东子易医药有限公司13173053288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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