Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (4-((dimethylamino)sulfonyl)phenyl)methyl ester, (1R-trans)-
Basic information
- CAS
82488-28-6- Standard SMILES
CC(C)=C[C@@H]1[C@@H](C(=O)OCc2ccc(S(=O)(=O)N(C)C)cc2)C1(C)C- InChIKey
SKUDHCXVIQEIIA-SJORKVTESA-N- Molecular formula
- C19H27NO4S
- Average molar mass
- 365.5 g/mol
- Monoisotopic mass
- 365.16607952
Names & identifiers
- Preferred name
- Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (4-((dimethylamino)sulfonyl)phenyl)methyl ester, (1R-trans)-
- IUPAC
- cis-[4-(dimethylsulfamoyl)phenyl]methyl (1R,3R)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxylate
Names & synonyms
82488-28-6Cyclopropanecarboxylic acid, 2,2-dimethyl-3-(2-methyl-1-propenyl)-, (4-((dimethylamino)sulfonyl)phenyl)methyl ester, (1R-trans)-DTXSID201002728[4-(DIMETHYLSULFAMOYL)PHENYL]METHYL (1R,3R)-2,2-DIMETHYL-3-(2-METHYLPROP-1-EN-1-YL)CYCLOPROPANE-1-CARBOXYLATE[4-(Dimethylsulfamoyl)phenyl]methyl 2,2-dimethyl-3-(2-methylprop-1-en-1-yl)cyclopropane-1-carboxylate
Database identifiers
- CAS
82488-28-6- PubChem CID
- 186259
- DTXSID
DTXSID201002728
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 618
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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