Rorifamide
Basic information
- CAS
53078-91-4- Standard SMILES
CS(=O)(=O)CCCCCCCCCC(N)=O- InChIKey
MZXDOHVJCAJUKK-UHFFFAOYSA-N- Molecular formula
- C11H23NO3S
- Average molar mass
- 249.37 g/mol
- Monoisotopic mass
- 249.13986477
Overview
crystalline substance isolated from herb Han-Tsai, Rorippa montana (Cruciferae); RN is from 9th CI; structure
Names & identifiers
- Preferred name
- Rorifamide
- IUPAC
- 10-methylsulfonyldecanamide
- English name
- 10-(METHYLSULFONYL)CAPRAMIDE
- Molecular formula
- C11H23NO3S
- Molecular weight
- 249.37
Names & synonyms
Rorifamide53078-91-4RefChem:17983910-methylsulfonyldecanamideDECANAMIDE, 10-(METHYLSULFONYL)-10-(Methylsulfonyl)decanamideorb1695417DTXSID6096758910-(Methanesulfonyl)decanimidic acid10-(METHYLSULFONYL)CAPRAMIDEAKOS027378785T34388
Show more names
10-(methylsulfonyl)-10-(Methylsulfonyl)acpramide10-(Methyl-sulfonyl)decanamide10-(Methylsulfonyl)decanamide Systematic Name
Database identifiers
- CAS
53078-91-4- PubChem CID
- 154173
- DTXSID
DTXSID60967589
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 85.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 280
Physicochemical properties
- Boiling point
- 479.3 · 479.3±18.0 °C(Predicted)
- Density
- 1.075 · 1.075±0.06 g/cm3(Predicted)
- pka
- 16.61 · 16.61±0.40(Predicted)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Applications
Uses10-(METHYLSULFONYL)CAPRAMIDE is an intermediate of purslane.
Upstream & downstream products
Upstream raw materials
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Related reactions
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Compound notes
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