2-(Dimethylamino)-2-(hydroxymethyl)propane-1,3-diol
Basic information
- CAS
1112-24-9- Standard SMILES
CN(C)C(CO)(CO)CO- InChIKey
FGLZHYIVVZTBQJ-UHFFFAOYSA-N- Molecular formula
- C6H15NO3
- Average molar mass
- 149.19 g/mol
- Monoisotopic mass
- 149.10519334
Names & identifiers
- Preferred name
- 2-(Dimethylamino)-2-(hydroxymethyl)propane-1,3-diol
- IUPAC
- 2-(dimethylamino)-2-(hydroxymethyl)propane-1,3-diol
- English name
- NSC17711
- Molecular formula
- C6H15NO3
- Molecular weight
- 149.19
Names & synonyms
1112-24-92-(dimethylamino)-2-(hydroxymethyl)propane-1,3-diol1,3-Propanediol, 2-(dimethylamino)-2-(hydroxymethyl)-NSC 17711DTXSID30275648EC 810-179-4RefChem:460771DTXCID10227069810-179-4NSC177112-Dimethylamino-2-hydroxymethylpropane-1,3-diol2-(Dimethylamino)-2-(hydroxymethyl)-1,3-propanediol
Show more names
2-Dimethylamino-2-hydroxymethyl-propane-1,3-diolorb180892SCHEMBL159962MFCD00632411NSC-17711STK448069AKOS003243396DB-060077
Database identifiers
- CAS
1112-24-9- PubChem CID
- 60042
- DTXSID
DTXSID30275648- EC Number
- 810-179-4
Properties
Computed structural properties
- XLogP
- -1.9
- Topological polar surface area
- 63.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 82.7
Physicochemical properties
- Melting point
- 90 °C · 90 °C
- Boiling point
- 304.8 · 304.8±37.0 °C(Predicted)
- Density
- 1.171 · 1.171±0.06 g/cm3(Predicted)
- pka
- 14.66 · 14.66±0.10(Predicted)
- EPA Substance Registry System
- 1 · 1,3-Propanediol, 2-(dimethylamino)-2-(hydroxymethyl)- (1112-24-9)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
- TSCA
- TSCA listed
- REACH Registrations
- Inactive
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
REACH registered substance: 2-(dimethylamino)-2-(hydroxymethyl)propane-1,3-diol (EC: 810-179-4)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- REACH Registrations
- Inactive
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Propanediol, 2-(dimethylamino)-2-(hydroxymethyl)-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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