Basic information
- CAS
73696-28-3- Standard SMILES
Cc1ccc(S(=O)(=O)N2CCC(=O)C2)cc1- InChIKey
BMJNDUPYCKAYAG-UHFFFAOYSA-N- Molecular formula
- C11H13NO3S
- Average molar mass
- 239.29 g/mol
- Monoisotopic mass
- 239.06161445
Names & identifiers
- Preferred name
- 1-(4-Tolylsulfonyl)pyrrolidin-3-one
- IUPAC
- 1-(4-methylphenyl)sulfonylpyrrolidin-3-one
- English name
- 1-Tosyl-3-pyrrolidinone
- Molecular formula
- C11H13NO3S
- Molecular weight
- 239.29
Names & synonyms
73696-28-31-(4-Tolylsulfonyl)pyrrolidin-3-oneDTXSID10336721RefChem:225594DTXCID50287809BMJNDUPYCKAYAG-UHFFFAOYSA-N1-tosylpyrrolidin-3-one1-TOSYL-3-PYRROLIDINONE1-(4-methylphenyl)sulfonylpyrrolidin-3-oneMFCD03659114F9995-18461-(4-METHYLBENZENESULFONYL)PYRROLIDIN-3-ONE
Show more names
1-[(4-Methylphenyl)sulfonyl]-3-pyrrolidinone3-Pyrrolidinone, 1-[(4-methylphenyl)sulfonyl]-
SCHEMBL265611SMSSF-05528431-(p-tolylsulfonyl)pyrrolidin-3-oneAKOS022364094SB38506DB-089402G625151-(4-Methylbenzene-1-sulfonyl)pyrrolidin-3-one
Database identifiers
- CAS
73696-28-3- PubChem CID
- 535802
- DTXSID
DTXSID10336721- Nikkaji
- J615.604E
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 363
Physicochemical properties
- Melting point
- 118 °C · 118 °C
- Boiling point
- 407 · 407.0±55.0 °C(Predicted)
- Density
- 1.33 · 1.330±0.06 g/cm3(Predicted)
- solubility
- Dichloromethane, Ethyl Acetate, Methanol
- form
- Solid
- pka
- -8.61 · -8.61±0.20(Predicted)
- color
- Brown
Chemistry & industry
Applications
Uses1-Tosyl-3-pyrrolidinone (cas# 73696-28-3) is a compound useful in organic synthesis.
Suppliers9 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [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]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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