2,4-Bis((dimethylamino)methyl)phenol
Basic information
- CAS
5424-54-4- Standard SMILES
CN(C)Cc1ccc(O)c(CN(C)C)c1- InChIKey
IVJXXQSXKSRPIL-UHFFFAOYSA-N- Molecular formula
- C12H20N2O
- Average molar mass
- 208.3 g/mol
- Monoisotopic mass
- 208.15756327
Names & identifiers
- Preferred name
- 2,4-Bis((dimethylamino)methyl)phenol
- IUPAC
- 2,4-bis[(dimethylamino)methyl]phenol
- English name
- 2,4-bis[(dimethylamino)methyl]phenol
- Molecular formula
- C12H20N2O
- Molecular weight
- 208.3
Names & synonyms
2,4-bis[(dimethylamino)methyl]phenol5424-54-42,4-Bis((dimethylamino)methyl)phenol4X2VB7S98PEINECS 226-567-6NSC-122342,4-bis(N,N-dimethylaminomethyl)phenolPhenol, 2,4-bis((dimethylamino)methyl)-DTXSID10202593NSC 122342,4-XYLENOL, .ALPHA.,.ALPHA.'-BIS(DIMETHYLAMINO)-RefChem:82208
Show more names
Phenol, 2,4-bis[(dimethylamino)methyl]-
DTXCID401250842,4-XYLENOL, ALPHA,ALPHA'-BIS(DIMETHYLAMINO)-226-567-62,4-bis(dimethylaminomethyl)phenolNSC12234UNII-4X2VB7S98PSCHEMBL1698928SCHEMBL29405336
Database identifiers
- CAS
5424-54-4- PubChem CID
- 79473
- DTXSID
DTXSID10202593- UNII
- 4X2VB7S98P
- EC Number
- 226-567-6
- Nikkaji
- J201.397E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 26.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- FDA UNII
- 4 X2VB7S98P · 4X2VB7S98P
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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