Basic information
- CAS
3392-10-7- Standard SMILES
CC(C)(C)OC(=O)N1CCCC1C(=O)ON1C(=O)CCC1=O- InChIKey
DICWIJISMKZDDY-UHFFFAOYSA-N- Molecular formula
- C14H20N2O6
- Average molar mass
- 312.32 g/mol
- Monoisotopic mass
- 312.13213636
Names & identifiers
- Preferred name
- 2,5-Dioxopyrrolidin-1-yl 1-(tert-butoxycarbonyl)prolinate
- IUPAC
- 1-O-tert-butyl 2-O-(2,5-dioxopyrrolidin-1-yl) pyrrolidine-1,2-dicarboxylate
- English name
- Boc-Pro-OSu
- Molecular formula
- C14H20N2O6
- Molecular weight
- 312.32
Names & synonyms
2,5-dioxopyrrolidin-1-yl 1-(tert-butoxycarbonyl)prolinateBoc-L-proline N-hydroxysuccinimide esterBoc-D-proline N-hydroxysuccinimide esterN-t-Boc-L-proline-N-hydroxysuccinimide Ester1-tert-butyl 2-(2,5-dioxopyrrolidin-1-yl) pyrrolidine-1,2-dicarboxylateOprea1_153813SCHEMBL357242DTXSID90955510EINECS 222-233-9STK1261071-O-tert-butyl 2-O-(2,5-dioxopyrrolidin-1-yl) pyrrolidine-1,2-dicarboxylateAKOS000496062
Show more names
1-O-tert-butyl 2-O-(2,5-dioxopyrrolidin-1-yl) (2S)-pyrrolidine-1,2-dicarboxylateBoc-Pro-OSuBoc-L-Pro-OSuBOC-PROLINE-OSUBOC-L-PROLINE-OSUN-Boc-L-Proline succinimidyl esterBOC-L-PROLINE HYDROXYSUCCINIMIDESTERN-Boc-L-proline N-succinimidyl esterBOC-L-PROLINE HYDROXYSUCCINIMIDE ESTER
AKOS022077648N-(TERT-BUTOXYCARBONYL)-L-PROLINE N-HYDROXYSUCCINIMIDE ESTERO1-tert-butyl O2-(2,5-dioxopyrrolidin-1-yl) pyrrolidine-1,2-dicarboxylatetert-Butyl (S)-2-(((2,5-dioxo-1-pyrrolidinyl)oxy)carbonyl)pyrrolidine-1-carboxylate
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 93.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 494
Physicochemical properties
- Melting point
- 133 · 133-135 °C
- Boiling point
- 421.3 · 421.3±55.0 °C(Predicted)
- Density
- 1.32 · 1.32±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- solubility
- DMF, Ethanol, Methanol
- form
- Solid
- pka
- -3.96 · -3.96±0.40(Predicted)
- color
- White Cyrstalline
- optical activity
- 20 · [α]20/D 56.0±1.0°, c = 2% in dioxane
- BRN
- 497537 · 497537
- Major Application
- peptide synthesis
- InChI
- 1S/C14H20N2O6/c1-14(2,3)21-13(20)15-8-4-5-9(15)12(19)22-16-10(17)6-7-11(16)18/h9H,4-8H2,1-3H3/t9-/m0/s1
- InChIKey
- DICWIJISMKZDDY-VIFPVBQESA-N
- SMILES
- CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)ON2C(=O)CCC2=O
- CAS DataBase Reference
- 3392 · 3392-10-7(CAS DataBase Reference)
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H317
- Precautionary statements
- P280
Chemistry & industry
Applications
Usespeptide synthesis
Upstream & downstream products
Downstream products
Suppliers42 total
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [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]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [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
天津卡普希科技有限公司022-66211079 13212288319 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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