Basic information
- CAS
3338-32-7- Standard SMILES
CC(C)(C)OC(=O)CC(NC(=O)OCc1ccccc1)C(=O)ON1C(=O)CCC1=O- InChIKey
JUMSBOKRGDETHL-UHFFFAOYSA-N- Molecular formula
- C20H24N2O8
- Average molar mass
- 420.4 g/mol
- Monoisotopic mass
- 420.15326573
Names & identifiers
- Preferred name
- tert-Butyl (S)-4-((2,5-dioxo-1-pyrrolidinyl)oxy)-4-oxo-3-(((phenylmethoxy)carbonyl)amino)butyrate
- IUPAC
- 4-O-tert-butyl 1-O-(2,5-dioxopyrrolidin-1-yl) 2-(phenylmethoxycarbonylamino)butanedioate
- English name
- Z-Asp(OtBu)-OSu
- Molecular formula
- C20H24N2O8
- Molecular weight
- 420.41
Names & synonyms
4-O-tert-butyl 1-O-(2,5-dioxopyrrolidin-1-yl) (2S)-2-(phenylmethoxycarbonylamino)butanedioatetert-Butyl (S)-4-((2,5-dioxo-1-pyrrolidinyl)oxy)-4-oxo-3-(((phenylmethoxy)carbonyl)amino)butyrateSCHEMBL17177676DTXSID00955001EINECS 222-080-84-O-tert-butyl 1-O-(2,5-dioxopyrrolidin-1-yl) 2-(phenylmethoxycarbonylamino)butanedioateN-Cbz-O4-tert-butyl-L-aspartic acid succinimido esterZ-L-aspartic acid b-tert-butyl ester a-N-hydroxysuccinimide ester(S)-4-tert-butyl 1-(2,5-dioxopyrrolidin-1-yl) 2-(benzyloxycarbonylamino)succinate4-tert-Butyl 1-(2,5-dioxopyrrolidin-1-yl) N-[(benzyloxy)(hydroxy)methylidene]aspartateO4-tert-butyl O1-(2,5-dioxopyrrolidin-1-yl) 2-(benzyloxycarbonylamino)butanedioateZ-ASP(OBUT)-OSU
Show more names
Z-Asp(OtBu)-OSuZ-L-Asp(tBu)-OSuZ-L-Asp(OtBu)-OSuCBZ-Asp(OtBu)-OsuCBZ-Asp(OBut)-OSuZ-ASPARTIC ACID(OTBU)-OSUZ-ASP(OTBU)-OSU USP/EP/BPZ-L-ASPARTIC ACID 4-TERT-BUTYL-1-(N- &
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 11
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 663
Physicochemical properties
- Melting point
- 150 · 150-152 °C
- Density
- 1.32 · 1.32±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- Powder
- pka
- 10.03 · 10.03±0.46(Predicted)
- color
- White to off-white
- Safety Statements
- 22 · 22-24/25
- WGK Germany
- 3 · 3
- F
- 3 · 3-10-21
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 3-10-21
- wgk
- 3
- safety_code
- 22-24/25
Chemistry & industry
Suppliers60 total
上海康恩博医药科技有限公司（科小研试剂）400-1388-521 17510465506 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Hangzhou Go Top Peptide Biotech0571-88211921 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
宁波亿诺化学品有限公司86-574-27787657 · [email protected]
常州安轩化工有限公司13912302692 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海安化生物技术有限公司021-61263375 18168859245
上海相辉医药科技有限公司13761987713 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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