alpha,alpha'-Bis(dimethylamino)-2,6-xylenol
Basic information
- CAS
15827-34-6- Standard SMILES
CN(C)Cc1cccc(CN(C)C)c1O- InChIKey
VUENIEFVRKDJAS-UHFFFAOYSA-N- Molecular formula
- C12H20N2O
- Average molar mass
- 208.3 g/mol
- Monoisotopic mass
- 208.15756327
Names & identifiers
- Preferred name
- alpha,alpha'-Bis(dimethylamino)-2,6-xylenol
- IUPAC
- 2,6-bis[(dimethylamino)methyl]phenol
- English name
- alpha,alpha'-bis(dimethylamino)-2,6-xylenol
- Molecular formula
- C12H20N2O
- Molecular weight
- 208.3
Names & synonyms
2,6-bis[(dimethylamino)methyl]phenol15827-34-6alpha,alpha'-Bis(dimethylamino)-2,6-xylenolNSC-115689EINECS 239-930-9alpha,alpha/'-bis(dimethylamino)-2,6-xylenolS7LA2SWH56SCHEMBL16987152,6-bis-dimethylaminomethylphenolDTXSID60166393VUENIEFVRKDJAS-UHFFFAOYSA-NNSC115689
Show more names
α,α'-bis(dimethylamino)-2,6-xylenol2,6-bis [(Dimethylamino) methyl] phenol
NSC 115689Phenol, 2,6-bis[(dimethylamino)methyl]-NS000217092,6-Xylenol, alpha,alpha'-bis(dimethylamino)-Alpha2,alpha6-bis-(dimethylamino)-2,6-xylenolAlpha^2,alpha^6-bis-(dimethylamino)-2,6-xylenol
Database identifiers
- CAS
15827-34-6- PubChem CID
- 85127
- DTXSID
DTXSID60166393- UNII
- S7LA2SWH56
- EC Number
- 239-930-9
- Nikkaji
- J201.399A
Properties
Computed structural properties
- XLogP
- 1.2
- 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
- 164
Physicochemical properties
- Boiling point
- 134 · 134-135 °C
- Density
- 1.036 · 1.036±0.06 g/cm3(Predicted)
- pka
- 7.25 · 7.25±0.50(Predicted)
- FDA UNII
- 7 LA2SWH56 · S7LA2SWH56
Chemistry & industry
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