Basic information
- CAS
639804-69-6- Standard SMILES
Nc1c(N=Nc2ccc([N+](=O)[O-])cc2)cc(S(=O)(=O)O)c2ccccc12- InChIKey
RFWOTQCDQPWBGD-UHFFFAOYSA-N- Molecular formula
- C16H12N4O5S
- Average molar mass
- 372.4 g/mol
- Monoisotopic mass
- 372.05284067
Names & identifiers
- Preferred name
- 4-Amino-3-[(4-nitrophenyl)diazenyl]naphthalene-1-sulfonic acid
- IUPAC
- 4-amino-3-[(4-nitrophenyl)diazenyl]naphthalene-1-sulfonic acid
Names & synonyms
639804-69-64-Amino-3-[2-(4-nitrophenyl)diazenyl]-1-naphthalenesulfonic acidAcid Red 74 Free AcidMHV8EZ5MT3SCHEMBL14704229SCHEMBL15606891SCHEMBL19921905C.I. Acid Red 74 Free AcidDTXSID0011704724-amino-3-[(4-nitrophenyl)diazenyl]naphthalene-1-sulfonic acid1-Naphthalenesulfonic acid, 4-amino-3-[(4-nitrophenyl)azo]-1-Naphthalenesulfonic acid, 4-amino-3-[2-(4-nitrophenyl)diazenyl]-
Show more names
1-Naphthalenesulfonic acid, 3,4-dihydro-4-imino-3-[2-(4-nitrophenyl)diazenyl]-3,4-Dihydro-4-imino-3-[2-(4-nitrophenyl)diazenyl]-1-naphthalenesulfonic acid
Database identifiers
- CAS
639804-69-6- PubChem CID
- 413200
- DTXSID
DTXSID001170472- UNII
- MHV8EZ5MT3
- Nikkaji
- J1.959.041K、J2.769.937E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 636
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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