Basic information
- CAS
25706-45-0- Standard SMILES
Nc1cccc(-c2cccc(N)c2O)c1O- InChIKey
PARGTJDYVRRGDB-UHFFFAOYSA-N- Molecular formula
- C12H12N2O2
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.08987763
Names & identifiers
- Preferred name
- 3,3'-Diamino[1,1'-biphenyl]-2,2'-diol
- IUPAC
- 2-amino-6-(3-amino-2-hydroxyphenyl)phenol
- English name
- 3,3'-Diaminobiphenyl-2,2'-diol
- Molecular formula
- C12H12N2O2
- Molecular weight
- 216.24
Names & synonyms
25706-45-0SCHEMBL565923SCHEMBL30175420DTXSID60514138PARGTJDYVRRGDB-UHFFFAOYSA-N2,2'-dihydroxy-3,3'-diaminobiphenyl3,3'-Diamino[1,1'-biphenyl]-2,2'-diol3,3'-Diaminobiphenyl-2,2'-diol[1,1'-Biphenyl]-2,2'-diol, 3,3'-diamino-
Database identifiers
- CAS
25706-45-0- PubChem CID
- 12964753
- DTXSID
DTXSID60514138- Nikkaji
- J88.374C
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 92.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 213
Related reactions
1 records
Compound notes
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