2,6-Diamino-4-methylbenzenesulfonic acid
Basic information
- CAS
128-55-2- Standard SMILES
Cc1cc(N)c(S(=O)(=O)O)c(N)c1- InChIKey
MNAWGAORJBFMTQ-UHFFFAOYSA-N- Molecular formula
- C7H10N2O3S
- Average molar mass
- 202.23 g/mol
- Monoisotopic mass
- 202.04121336
Names & identifiers
- Preferred name
- 2,6-Diamino-4-methylbenzenesulfonic acid
- IUPAC
- 2,6-diamino-4-methylbenzenesulfonic acid
Names & synonyms
2,6-diamino-4-methylbenzenesulfonic acid128-55-2DTXSID60278506RefChem:248136DTXCID10229664NSC7836SCHEMBL178781973,5-Diamino-p-toluolsulfonsaurep-Toluenesulfonic acid,6-diamino-2,6-Diamino-p-toluenesulfonic acidNSC-7836Benzenesulfonic acid,6-diamino-4-methyl-
Show more names
2,6-Diamino-4-methylbenzene-1-sulfonic acid
Database identifiers
- CAS
128-55-2- PubChem CID
- 222229
- DTXSID
DTXSID60278506
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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