2H-1,2-Benzothiazin-3(4H)-one, 2-allyl-, 1,1-dioxide
Basic information
- CAS
31848-18-7- Standard SMILES
C=CCN1C(=O)Cc2ccccc2S1(=O)=O- InChIKey
UQTCYVCSUDXQQN-UHFFFAOYSA-N- Molecular formula
- C11H11NO3S
- Average molar mass
- 237.28 g/mol
- Monoisotopic mass
- 237.04596439
Names & identifiers
- Preferred name
- 2H-1,2-Benzothiazin-3(4H)-one, 2-allyl-, 1,1-dioxide
- IUPAC
- 1,1-dioxo-2-prop-2-enyl-4H-1λ6,2-benzothiazin-3-one
Names & synonyms
31848-18-72H-1,2-Benzothiazin-3(4H)-one, 2-allyl-, 1,1-dioxideRefChem:1064964BRN 06509972-Allyl-2H-1,2-benzothiazin-3(4H)-one 1,1-dioxideDTXSID809537622-(Prop-2-en-1-yl)-1lambda~6~,2-benzothiazine-1,1,3(2H,4H)-trione
Database identifiers
- CAS
31848-18-7- PubChem CID
- 208259
- DTXSID
DTXSID80953762
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 396
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…