Basic information
- CAS
3651-02-3- Standard SMILES
Oc1ccc(N=Nc2ccccc2)c2ccccc12- InChIKey
CQYDCXNJLAOBIF-UHFFFAOYSA-N- Molecular formula
- C16H12N2O
- Average molar mass
- 248.28 g/mol
- Monoisotopic mass
- 248.094963
Names & identifiers
- Preferred name
- 1-Naphthalenol, 4-(phenylazo)-
- IUPAC
- 4-phenyldiazenylnaphthalen-1-ol
- English name
- 4-(phenylazo)-1-naphthol
- Molecular formula
- C16H12N2O
- Molecular weight
- 248.28
Names & synonyms
1-Naphthalenol, 4-(phenylazo)-RefChem:4350111-Naphthalenol, 4-(phenylazo)-(9CI)4-(Phenylazo)-1-naphthol3651-02-3C.I. Solvent Brown 44-(2-phenyldiazenyl)-1-NaphthalenolOrganol Brown N1-(Phenylazo)-4-naphtholHexatype Brown AOhio Brown AA4-phenyldiazenylnaphthalen-1-ol
Show more names
C.I.12000Nsc 28487Solvent Brown 4Einecs 222-891-7C.I.Solvent Brown 44-(Phenylazo)-1-naphthalenolC.I.Solvent Brown 4:C.I.12000
1-Naphthol, 4-(phenylazo)-4-[(E)-phenyldiazenyl]-1-naphtholC.I. 120004-phenylazo-1-naphthol4-(phenyldiazenyl)naphtholSCHEMBL3284638SCHEMBL3284642CQYDCXNJLAOBIF-UHFFFAOYSA-N
Database identifiers
- CAS
3651-02-3- PubChem CID
- 77214
- DTXSID
DTXSID701367452- EC Number
- 222-891-7
- Nikkaji
- J2.430.626G、J2.430.627E、J37.822D、J499.299G
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 312
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Boiling point
- 391.35 °C · 391.35°C (rough estimate)
- Density
- 1.1077 · 1.1077 (rough estimate)
- refractive index
- 1.58 · 1.5800 (estimate)
Safety & regulation
Hazard information
Regulatory Information
Chemical: 1-Naphthalenol, 4-(phenylazo)-
1-Naphthalenol, 4-(phenylazo)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Chemistry & industry
Preparation methods
Preparationaniline diazotization, and Naphthalen-1-ol coupling.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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