2-chloro-5-iodo-N-(pyridin-3-ylmethylideneamino)benzamide
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Basic information
- CAS
331668-28-1- Standard SMILES
O=C(NN=Cc1cccnc1)c1cc(I)ccc1Cl- InChIKey
CVDSBAHXYLEPRU-UHFFFAOYSA-N- Molecular formula
- C13H9ClIN3O
- Average molar mass
- 385.59 g/mol
- Monoisotopic mass
- 384.94789
Names & identifiers
- Preferred name
- 2-chloro-5-iodo-N-(pyridin-3-ylmethylideneamino)benzamide
- IUPAC
- 2-chloro-5-iodo-N-(pyridin-3-ylmethylideneamino)benzamide
- English name
- 2-chloro-5-iodo-N'-(3-pyridinylmethylene)benzohydrazide
- Molecular formula
- C13H9ClIN3O
- Molecular weight
- 385.59
Names & synonyms
2-chloro-5-iodo-N'-(3-pyridinylmethylene)benzohydrazide
Database identifiers
- CAS
331668-28-1- PubChem CID
- 622227
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Physicochemical properties
- Density
- 1.727 · 1.727±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.77 · 10.770±0.46(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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