Ethyl (4-phenyl-2H-1,3-dithiol-2-ylidene)carbamate
Basic information
- CAS
62538-70-9- Standard SMILES
CCOC(=O)N=c1scc(-c2ccccc2)s1- InChIKey
JZKDZMMXPZOYAY-UHFFFAOYSA-N- Molecular formula
- C12H11NO2S2
- Average molar mass
- 265.4 g/mol
- Monoisotopic mass
- 265.02312094
Names & identifiers
- Preferred name
- Ethyl (4-phenyl-2H-1,3-dithiol-2-ylidene)carbamate
- IUPAC
- ethyl N-(4-phenyl-1,3-dithiol-2-ylidene)carbamate
Names & synonyms
62538-70-9Ethyl (4-phenyl-2H-1,3-dithiol-2-ylidene)carbamateDTXSID70807669
Database identifiers
- CAS
62538-70-9- PubChem CID
- 71385437
- DTXSID
DTXSID70807669
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 346
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Related reactions
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Compound notes
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