4-Chloro-N-dodecyl-1-hydroxynaphthalene-2-carboxamide
Basic information
- CAS
7588-27-4- Standard SMILES
CCCCCCCCCCCCNC(=O)c1cc(Cl)c2ccccc2c1O- InChIKey
VWWDUUNNMSGWHY-UHFFFAOYSA-N- Molecular formula
- C23H32ClNO2
- Average molar mass
- 390 g/mol
- Monoisotopic mass
- 389.212157
Names & identifiers
- Preferred name
- 4-Chloro-N-dodecyl-1-hydroxynaphthalene-2-carboxamide
- IUPAC
- 4-chloro-N-dodecyl-1-hydroxynaphthalene-2-carboxamide
- English name
- 4-chloro-N-dodecyl-1-hydroxynaphthalene-2-carboxamide
- Molecular formula
- C23H32ClNO2
- Molecular weight
- 389.96
Names & synonyms
4-Chloro-N-dodecyl-1-hydroxynaphthalene-2-carboxamide7588-27-4EINECS 231-496-9SCHEMBL11598238DTXSID80226781NS000377352-Naphthalenecarboxamide, 4-chloro-N-dodecyl-1-hydroxy-1-Hydroxy-4-chloro-N-dodecyl-2-naphthamide
Database identifiers
- CAS
7588-27-4- PubChem CID
- 82066
- DTXSID
DTXSID80226781- EC Number
- 231-496-9
- Nikkaji
- J170.871F
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 417
Physicochemical properties
- Boiling point
- 536.6 · 536.6±40.0 °C(Predicted)
- Density
- 1.095 · 1.095±0.06 g/cm3(Predicted)
- pka
- 7.62 · 7.62±0.50(Predicted)
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Related reactions
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Compound notes
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