Basic information
- CAS
959582-83-3- Standard SMILES
CC(C)(C)OC(=O)N1C[C@H](Cc2ccc(Cl)cc2Cl)C[C@H]1C(=O)O- InChIKey
OSYGWQSBSONFKO-YGRLFVJLSA-N- Molecular formula
- C17H21Cl2NO4
- Average molar mass
- 374.3 g/mol
- Monoisotopic mass
- 373.0847635
Names & identifiers
- Preferred name
- (2S,4R)-1-(tert-Butoxycarbonyl)-4-(2,4-dichlorobenzyl)pyrrolidine-2-carboxylic acid
- IUPAC
- (2S,4R)-4-[(2,4-dichlorophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
- English name
- (2S,4R)-1-(tert-butoxycarbonyl)-4-(2,4-dichlorobenzyl)pyrrolidine-2-carboxylic acid
- Molecular formula
- C17H21Cl2NO4
- Molecular weight
- 374.26
Names & synonyms
959582-83-3(2S,4R)-1-(tert-Butoxycarbonyl)-4-(2,4-dichlorobenzyl)pyrrolidine-2-carboxylic acidBoc-(R)-gamma-(2,4-dichloro-benzyl)-L-prolineMFCD06659420(2S,4R)-4-[(2,4-dichlorophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acidN-Boc-(4R)-4-(2,4-dichlorobenzyl)-L-proline(2S,4R)-1-[(tert-butoxy)carbonyl]-4-[(2,4-dichlorophenyl)methyl]pyrrolidine-2-carboxylic acid(2S,4R)-1-(tert-Butoxycarbonyl)-4-(2,4-dichlorobenzyl)-pyrrolidine-2-carboxylic acidtrans-N-Boc-4-(2,4-dichlorobenzyl)-L-prolineSCHEMBL1375428DTXSID40376034AKOS015949884
Show more names
Boc-(R)-γ-(24-dichloro-benzyl)-L-Pro4-dichloro-benzyl)-L-pr oline(Tert-Butoxy)Carbonyl (R)-γ-(2Boc-(R)-3-(2,4-dichloro-benzyl)-L-prolineBoc-(R)-γ-(2,4-dichloro-benzyl)-L-proline(Tert-Butoxy)Carbonyl (R)-γ-(2,4-dichloro-benzyl)-L-ProN-(t-Butoxycarbonyl)-trans-4-(2,4-dichlorobenzyl)-L-proline
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 480
Physicochemical properties
- Melting point
- 116 · 116-118℃
- Boiling point
- 494.97 · 494.970±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.33 · 1.330±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.932 · 3.932±0.40(predicted)
Chemistry & industry
Suppliers31 total
陕西科贝莱药物研发有限公司13119135307 13119135307 · [email protected]
江苏吉泰肽业科技有限公司18936337900 18936337900 · [email protected]
江苏生康迈翔科技有限公司18217475093 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [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
Shanghai Hanhong Scientific Co., Ltd.+undefined17612118332 · [email protected]
上海海皋科技有限公司021-57646680 18306277365 · [email protected]
无锡亚肽生物科技有限公司0510-83583050 13771062561 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
深圳乾延药物研发科技有限公司0755-28682735 13538090636 · [email protected]
上海吉尔多肽有限公司+86-21-61263310 13764994101 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
南京肽业生物科技有限公司
Related reactions
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Compound notes
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