2-[(2-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethylideneamino)acetamide
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Basic information
- CAS
332420-16-3- Standard SMILES
O=C(CSCc1ccccc1Cl)NN=Cc1ccco1- InChIKey
BAWTYYUTWLWQNI-UHFFFAOYSA-N- Molecular formula
- C14H13ClN2O2S
- Average molar mass
- 308.8 g/mol
- Monoisotopic mass
- 308.0386265
Names & identifiers
- Preferred name
- 2-[(2-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethylideneamino)acetamide
- IUPAC
- 2-[(2-chlorophenyl)methylsulfanyl]-N-(furan-2-ylmethylideneamino)acetamide
- English name
- 2-[(2-chlorobenzyl)sulfanyl]-N'-(2-furylmethylene)acetohydrazide
- Molecular formula
- C14H13ClN2O2S
- Molecular weight
- 308.78
Names & synonyms
HMS2602A232-[(2-chlorobenzyl)sulfanyl]-N'-(2-furylmethylene)acetohydrazide
Database identifiers
- CAS
332420-16-3- PubChem CID
- 809289
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 79.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 341
Physicochemical properties
- Density
- 1.297 · 1.297±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.235 · 12.235±0.46(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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