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Basic information
- CAS
92235-35-3- Standard SMILES
CN1CC[C@H](NC(=O)OC(C)(C)C)C1=O- InChIKey
AQTGZJWIZODIFY-ZETCQYMHSA-N- Molecular formula
- C10H18N2O3
- Average molar mass
- 214.26 g/mol
- Monoisotopic mass
- 214.13174244
Names & identifiers
- Preferred name
- (S)-tert-Butyl (1-methyl-2-oxopyrrolidin-3-yl)carbamate
- IUPAC
- tert-butyl N-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]carbamate
- English name
- tert-butyl (S)-1-methyl-2-oxopyrrolidin-3-ylcarbamate
- Molecular formula
- C10H18N2O3
- Molecular weight
- 214.26
Names & synonyms
92235-35-3(S)-tert-Butyl (1-methyl-2-oxopyrrolidin-3-yl)carbamateMFCD29921931tert-Butyl (S)-(1-methyl-2-oxopyrrolidin-3-yl)carbamatetert-butyl N-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]carbamate(S)-(1-Methyl-2-oxo-pyrrolidin-3-yl)-carbamicacidtert-butylesterSCHEMBL4099515(S)-tert-butyl 1-methyl-2-oxopyrrolidin-3-ylcarbamateAQTGZJWIZODIFY-ZETCQYMHSA-NDTXSID101167937CS-0254214F14318
Show more names
(S)-3-(Boc-amino)-1-methylpyrrolidin-2-one(S)-(1-Methyl-2-oxo-pyrrolidin-3-yl)-carbamic acid tert-butyl esterCarbamic acid, N-[(3S)-1-methyl-2-oxo-3-pyrrolidinyl]-, 1,1-dimethylethyl ester
(S)-3-(Boc-amino)-1-methyl-2-oxo-pyrrolidineF667893t-Butyl (S)-1-methyl-2-oxopyrrolidin-3-ylcarbamate(S)-tert-Butyl(1-methyl-2-oxopyrrolidin-3-yl)carbamatetert-Butyl [(3S)-1-methyl-2-oxopyrrolidin-3-yl]carbamateTERT-BUTYL (S)-1-METHYL-2-OXOPYRROLIDIN-3-YLCARBAMATE1,1-Dimethylethyl N-[(3S)-1-methyl-2-oxo-3-pyrrolidinyl]carbamate
Database identifiers
Properties
Computed structural propertiesFilling in
- XLogP
- 0.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 270
Physicochemical properties
- Boiling point
- 363.5 · 363.5±31.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- pka
- 11.38 · 11.38±0.20(Predicted)
Chemistry & industry
Suppliers9 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 4008675858 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
河北药成医药科技有限责任公司19903117510 19903117580 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
Related reactions
2 records
Compound notes
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