2-(3-hydroxyphenyl)-1H-indole-4,7-diol
Basic information
- CAS
70178-13-1- Standard SMILES
Oc1cccc(-c2cc3c(O)ccc(O)c3[nH]2)c1- InChIKey
JTUZMVMXDQUGQJ-UHFFFAOYSA-N- Molecular formula
- C14H11NO3
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.07389321
Names & identifiers
- Preferred name
- 2-(3-hydroxyphenyl)-1H-indole-4,7-diol
- IUPAC
- 2-(3-hydroxyphenyl)-1H-indole-4,7-diol
Names & synonyms
70178-13-12-(3-hydroxyphenyl)-1H-indole-4,7-diolNSC234023DTXSID80310896NSC-234023
Database identifiers
- CAS
70178-13-1- PubChem CID
- 314684
- DTXSID
DTXSID80310896
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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