Basic information
- CAS
183136-12-1- Standard SMILES
CC(C)(C)NC(=O)OCCn1sc2ccccc2c1=O- InChIKey
WZZYCYUKDAFNOZ-UHFFFAOYSA-N- Molecular formula
- C14H18N2O3S
- Average molar mass
- 294.37 g/mol
- Monoisotopic mass
- 294.10381361
Names & identifiers
- Preferred name
- (1,1-Dimethylethyl)carbamic acid 2-(3-oxo-1,2-benzisothiazol-2(3H)-yl)ethyl ester
- IUPAC
- 2-(3-oxo-1,2-benzothiazol-2-yl)ethyl N-tert-butylcarbamate
Names & synonyms
183136-12-1(1,1-Dimethylethyl)carbamic acid 2-(3-oxo-1,2-benzisothiazol-2(3H)-yl)ethyl esterDTXSID309396922-(3-oxo-1,2-benzothiazol-2-yl)ethyl N-tert-butylcarbamate2-(3-Oxo-1,2-benzothiazol-2(3H)-yl)ethyl hydrogen tert-butylcarbonimidateCarbamic acid, (1,1-dimethylethyl)-, 2-(3-oxo-1,2-benzisothiazol-2(3H)-yl)ethyl ester
Database identifiers
- CAS
183136-12-1- PubChem CID
- 465166
- DTXSID
DTXSID30939692- Nikkaji
- J780.422I
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 83.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 381
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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