Basic information
- CAS
5864-85-7- Standard SMILES
COc1ccc(C)cc1N=Nc1c(S(=O)(=O)[O-])cc2ccc(S(=O)(=O)[O-])cc2c1O.[Na+].[Na+]- InChIKey
LQHGEMMLQBEXDA-UHFFFAOYSA-L- Molecular formula
- C18H14N2Na2O8S2
- Average molar mass
- 496.4 g/mol
- Monoisotopic mass
- 495.99869632
Names & identifiers
- Preferred name
- 2,6-Naphthalenedisulfonic acid, 4-hydroxy-3-((2-methoxy-5-methylphenyl)azo)-, disodium salt
- IUPAC
- disodium;4-hydroxy-3-[(2-methoxy-5-methylphenyl)diazenyl]naphthalene-2,6-disulfonate
Names & synonyms
2,6-Naphthalenedisulfonic acid, 4-hydroxy-3-((2-methoxy-5-methylphenyl)azo)-, disodium salt5864-85-7C.I. Acid Red 22 disodium saltDTXSID601023156
Database identifiers
- CAS
5864-85-7- PubChem CID
- 22154
- DTXSID
DTXSID601023156- EC Number
- 611-729-4
Properties
Computed structural properties
- Topological polar surface area
- 185 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 809
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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