2-Naphthalenecarboxamide, N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-
Basic information
- CAS
5165-81-1- Standard SMILES
COc1cc(Cl)c(C)cc1NC(=O)c1cc2ccccc2cc1O- InChIKey
COXPEQKIFMVQIO-UHFFFAOYSA-N- Molecular formula
- C19H16ClNO3
- Average molar mass
- 341.8 g/mol
- Monoisotopic mass
- 341.0818711
Names & identifiers
- Preferred name
- 2-Naphthalenecarboxamide, N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-
- IUPAC
- N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxynaphthalene-2-carboxamide
- English name
- naphthol AS-RS
- Molecular formula
- C19H16ClNO3
- Molecular weight
- 341.79
Names & synonyms
5165-81-12-Naphthalenecarboxamide, N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-EINECS 225-946-3DTXSID1063724NSC 50689RefChem:476560DTXCID2041048N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxynaphthalene-2-carboxamideN3ZQ2NPW7W4'-Chloro-3-hydroxy-2'-methoxy-5'-methyl-2-naphthanilideNSC-506892-Naphth-o-anisidide, 4'-chloro-3-hydroxy-5'-methyl-
Show more names
C.I.37541naphthol AS-RSNaphtol AS-RS.Naphtanilide RSAzoic Coupling Component 28C.I.Azoic Coupling Component 28C.I.Azoic Coupling Component 28:C.I.37541N-(4-Chloro-5-methyl-2-methoxyphenyl)-3-hydroxy-2-naphthamideN-(2-Methoxy-4-chloro-5-methylphenyl)-3-hydroxy-2-naphthamide
UNII-N3ZQ2NPW7WC.I. 37541SCHEMBL10423848SCHEMBL29612245COXPEQKIFMVQIO-UHFFFAOYSA-NC.I. Azoic Coupling Component 28NSC50689N-(4-CHLORO-2-METHOXY-5-METHYLPHENYL)-3-HYDROXY-2-NAPHTHALENECARBOXAMIDE
Database identifiers
- CAS
5165-81-1- PubChem CID
- 78844
- DTXSID
DTXSID1063724- UNII
- N3ZQ2NPW7W
- EC Number
- 225-946-3
- Nikkaji
- J73.260E
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 446
Physicochemical properties
- Boiling point
- 458.9 · 458.9±45.0 °C(Predicted)
- Density
- 1.35 · 1.350±0.06 g/cm3(Predicted)
- pka
- 8.68 · 8.68±0.40(Predicted)
- FDA UNII
- 3 ZQ2NPW7W · N3ZQ2NPW7W
- EPA Substance Registry System
- 2 · 2-Naphthalenecarboxamide, N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy- (5165-81-1)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 2-Naphthalenecarboxamide, N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Naphthalenecarboxamide, N-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-: INACTIVE
Preparation methods
Preparation4-Chloro-2-methoxy-5-methylbenzenaminein pyridine withN-(4-chloro-2-methoxy-5-methylphenyl)-3-hydroxy-2-naphthamide condensation.
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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