Basic information
- CAS
7462-44-4- Standard SMILES
Oc1ccc(O)c(CNCc2ccccc2)c1CNCc1ccccc1- InChIKey
JDHCCLMDMPNEET-UHFFFAOYSA-N- Molecular formula
- C22H24N2O2
- Average molar mass
- 348.4 g/mol
- Monoisotopic mass
- 348.18377801
Names & identifiers
- Preferred name
- 2,3-Bis[(benzylamino)methyl]benzene-1,4-diol
- IUPAC
- 2,3-bis[(benzylamino)methyl]benzene-1,4-diol
Names & synonyms
7462-44-42,3-bis[(benzylamino)methyl]benzene-1,4-diolNSC402107DTXSID80322818NSC-402107
Database identifiers
- CAS
7462-44-4- PubChem CID
- 344934
- DTXSID
DTXSID80322818
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 64.5 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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