Basic information
- CAS
52695-54-2- Standard SMILES
CCOc1ccc(C)cc1N=Nc1ccc(N=Nc2cccc(S(=O)(=O)O)c2)c2ccccc12- InChIKey
FYUIEFVEQGWFII-UHFFFAOYSA-N- Molecular formula
- C25H22N4O4S
- Average molar mass
- 474.5 g/mol
- Monoisotopic mass
- 474.13617637
Names & identifiers
- Preferred name
- Benzenesulfonic acid, 3-(2-(4-(2-(2-ethoxy-5-methylphenyl)diazenyl)-1-naphthalenyl)diazenyl)-
- IUPAC
- 3-[[4-[(2-ethoxy-5-methylphenyl)diazenyl]naphthalen-1-yl]diazenyl]benzenesulfonic acid
- English name
- 3-[[4-[(2-ethoxy-5-methylphenyl)azo]-1-naphthyl]azo]benzenesulphonic acid
- Molecular formula
- C25H22N4O4S
- Molecular weight
- 474.53
Names & synonyms
EINECS 258-109-6Benzenesulfonic acid, 3-((4-((2-ethoxy-5-methylphenyl)azo)-1-naphthalenyl)azo)-Benzenesulfonic acid, 3-(2-(4-(2-(2-ethoxy-5-methylphenyl)diazenyl)-1-naphthalenyl)diazenyl)-Benzenesulfonic acid, 3-[[4-[(2-ethoxy-5-methylphenyl)azo]-1-naphthalenyl]azo]-Benzenesulfonic acid, 3-[2-[4-[2-(2-ethoxy-5-methylphenyl)diazenyl]-1-naphthalenyl]diazenyl]-RefChem:56428352695-54-2DTXSID0068783SCHEMBL28319825FYUIEFVEQGWFII-UHFFFAOYSA-N3-((4-((2-Ethoxy-5-methylphenyl)azo)-1-naphthyl)azo)benzenesulphonic acidDB-314997
Show more names
3-[[4-[(2-ethoxy-5-methylphenyl)azo]-1-naphthyl]azo]benzenesulphonic acid3-[[4-[(2-Ethoxy-5-methylphenyl)azo]-1-naphthalenyl]azo]benzenesulfonic acid
NS000325553-({4-[(2-Ethoxy-5-methylphenyl)diazenyl]naphthalen-1-yl}diazenyl)benzene-1-sulfonic acid3-[[4-[(2-Ethoxy-5-methylphenyl)azo]-1-naphthyl ]azo]benzenesulphonic acid3-[2-[4-[2-(2-Ethoxy-5-methylphenyl)diazenyl]-1-naphthalenyl]diazenyl]benzenesulfonic acid
Database identifiers
- CAS
52695-54-2- PubChem CID
- 104286
- DTXSID
DTXSID0068783- EC Number
- 258-109-6
- Nikkaji
- J295.771J
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 814
Physicochemical properties
- Density
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- pka
- -0.92 · -0.92±0.30(Predicted)
- EPA Substance Registry System
- 3 · Benzenesulfonic acid, 3-[[4-[(2-ethoxy-5-methylphenyl)azo]-1-naphthalenyl]azo]- (52695-54-2)
- 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.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenesulfonic acid, 3-[2-[4-[2-(2-ethoxy-5-methylphenyl)diazenyl]-1-naphthalenyl]diazenyl]-: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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