Basic information
- CAS
118207-99-1- Standard SMILES
CN(C)CCOC(=O)c1ccccc1N=Nc1c(O)ccc2ccccc12.Cl- InChIKey
KDCABFSKIRXMLK-UHFFFAOYSA-N- Molecular formula
- C21H21N3O3.ClH
- Average molar mass
- 399.9 g/mol
- Monoisotopic mass
- 399.1349693
Names & identifiers
- Preferred name
- Benzoic acid, 2-[(2-hydroxy-1-naphthalenyl)azo]-, 2-(dimethylamino)ethyl ester, monohydrochloride
- IUPAC
- 2-(dimethylamino)ethyl 2-[(2-hydroxynaphthalen-1-yl)diazenyl]benzoate;hydrochloride
- English name
- BASAZOLORANGE8512
- Molecular formula
- C21H21N3O3.ClH
- Molecular weight
- 399.87
Names & synonyms
Basazol Orange 8512Benzoic acid, 2-((2-hydroxy-1-naphthalenyl)azo)-, 2-(dimethylamino)ethyl ester, monohydrochlorideDTXSID1073812Benzoic acid, 2-[(2-hydroxy-1-naphthalenyl)azo]-, 2-(dimethylamino)ethyl ester, monohydrochlorideRefChem:565469DTXCID7033444118207-99-1KDCABFSKIRXMLK-UHFFFAOYSA-NNS000238032-(Dimethylamino)ethyl 2-[(2-hydroxynaphthalen-1-yl)diazenyl]benzoate--hydrogen chloride (1/1)BASAZOLORANGE8512
Database identifiers
- CAS
118207-99-1- PubChem CID
- 86346
- DTXSID
DTXSID1073812- EC Number
- 601-512-2
Properties
Computed structural properties
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 511
Physicochemical properties
- EPA Substance Registry System
- 2 · Benzoic acid, 2-[(2-hydroxy-1-naphthalenyl)azo]-, 2-(dimethylamino)ethyl ester, monohydrochloride (118207-99-1)
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: Benzoic acid, 2-[(2-hydroxy-1-naphthalenyl)azo]-, 2-(dimethylamino)ethyl ester, monohydrochloride
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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