5-Isoindolinesulfonamide, 2-allyl-6-chloro-1,3-dioxo-
Basic information
- CAS
3862-01-9- Standard SMILES
C=CCN1C(=O)c2cc(Cl)c(S(N)(=O)=O)cc2C1=O- InChIKey
LDTCLBDGNNENEM-UHFFFAOYSA-N- Molecular formula
- C11H9ClN2O4S
- Average molar mass
- 300.72 g/mol
- Monoisotopic mass
- 299.9971556
Names & identifiers
- Preferred name
- 5-Isoindolinesulfonamide, 2-allyl-6-chloro-1,3-dioxo-
- IUPAC
- 6-chloro-1,3-dioxo-2-prop-2-enylisoindole-5-sulfonamide
Names & synonyms
BRN 04311915-ISOINDOLINESULFONAMIDE, 2-ALLYL-6-CHLORO-1,3-DIOXO-3862-01-9DTXSID901919362-Allyl-6-chloro-1,3-dioxo-5-isoindolinesulfonamide1H-Isoindole-5-sulfonamide, 6-chloro-2,3-dihydro-1,3-dioxo-2-(2-propenyl)-5-22-07-00597 (Beilstein Handbook Reference)RefChem:303583DTXCID301144276-chloro-1,3-dioxo-2-(prop-2-en-1-yl)-2,3-dihydro-1H-isoindole-5-sulfonamide
Database identifiers
- CAS
3862-01-9- PubChem CID
- 19734
- DTXSID
DTXSID90191936
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 527
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Related reactions
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Compound notes
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