Basic information
- CAS
1286208-44-3- Standard SMILES
CC(C)C(=O)N1CC[C@H](NC(=O)OC(C)(C)C)C1- InChIKey
TXXXAAPSSKSRTC-JTQLQIEISA-N- Molecular formula
- C13H24N2O3
- Average molar mass
- 256.34 g/mol
- Monoisotopic mass
- 256.17869263
Names & identifiers
- Preferred name
- (S)-tert-Butyl 1-isobutyrylpyrrolidin-3-ylcarbamate
- IUPAC
- tert-butyl N-[(3S)-1-(2-methylpropanoyl)pyrrolidin-3-yl]carbamate
- English name
- (S)-tert-Butyl 1-isobutyrylpyrrolidin-3-ylcarbamate
- Molecular formula
- C13H24N2O3
- Molecular weight
- 256.34
Names & synonyms
1286208-44-3(S)-tert-Butyl 1-isobutyrylpyrrolidin-3-ylcarbamatetert-butyl N-[(3S)-1-(2-methylpropanoyl)pyrrolidin-3-yl]carbamate(S)-tert-Butyl (1-isobutyrylpyrrolidin-3-yl)carbamate(S)-tert-Butyl(1-isobutyrylpyrrolidin-3-yl)carbamateSCHEMBL18820638DTXSID301122727MFCD18378086AKOS027386134KS-6453F064255tert-Butyl [(3S)-1-(2-methylpropanoyl)pyrrolidin-3-yl]carbamate
Show more names
tert-butyl (S)-(1-isobutyrylpyrrolidin-3-yl)carbamate
Carbamic acid, N-[(3S)-1-(2-methyl-1-oxopropyl)-3-pyrrolidinyl]-, 1,1-dimethylethyl ester
Database identifiers
- CAS
1286208-44-3- PubChem CID
- 53256331
- DTXSID
DTXSID301122727
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
Chemistry & industry
Suppliers2 total
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
佰美济华（河南）医药科技有限公司0371-88900765 18037465274 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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