N-butyl-4-[(2,5-dimethoxyphenyl)azo]-3-hydroxynaphthalene-2-carboxamide
Basic information
- CAS
10000-56-3- Standard SMILES
CCCCNC(=O)c1cc2ccccc2c(N=Nc2cc(OC)ccc2OC)c1O- InChIKey
BYXVUFFSLNCCLH-UHFFFAOYSA-N- Molecular formula
- C23H25N3O4
- Average molar mass
- 407.5 g/mol
- Monoisotopic mass
- 407.18450629
Names & identifiers
- Preferred name
- N-butyl-4-[(2,5-dimethoxyphenyl)azo]-3-hydroxynaphthalene-2-carboxamide
- IUPAC
- N-butyl-4-[(2,5-dimethoxyphenyl)diazenyl]-3-hydroxynaphthalene-2-carboxamide
- English name
- N-butyl-4-[(2,5-dimethoxyphenyl)azo]-3-hydroxynaphthalene-2-carboxamide
- Molecular formula
- C23H25N3O4
- Molecular weight
- 407.46
Names & synonyms
10000-56-3N-butyl-4-[(2,5-dimethoxyphenyl)azo]-3-hydroxynaphthalene-2-carboxamideN-butyl-4-[(2,5-dimethoxyphenyl)diazenyl]-3-hydroxynaphthalene-2-carboxamideN-Butyl-4-((2,5-dimethoxyphenyl)azo)-3-hydroxynaphthalene-2-carboxamideN-Butyl-4-[2-(2,5-dimethoxyphenyl)diazenyl]-3-hydroxy-2-naphthalenecarboxamideEINECS 232-997-5BYXVUFFSLNCCLH-UHFFFAOYSA-NDTXSID701137794NS000446122-Naphthalenecarboxamide, N-butyl-4-[2-(2,5-dimethoxyphenyl)diazenyl]-3-hydroxy-N-Butyl-4-[(2,5-dimethoxyphenyl)azo]-3-hydroxy-2-naphthalenecarboxamide
Database identifiers
- CAS
10000-56-3- PubChem CID
- 82284
- DTXSID
DTXSID701137794- EC Number
- 232-997-5
- Nikkaji
- J241.213F
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 92.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 573
Physicochemical properties
- Melting point
- 161 · 161-164 °C
- Boiling point
- 631.446 · 631.446±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.212 · 1.212±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.883 · 12.883±0.50(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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