2,6-Bis((dimethylamino)methyl)-3-pyridinol
Basic information
- CAS
2168-17-4- Standard SMILES
CN(C)Cc1ccc(O)c(CN(C)C)n1- InChIKey
OYTNPZVGHDQVGL-UHFFFAOYSA-N- Molecular formula
- C11H19N3O
- Average molar mass
- 209.29 g/mol
- Monoisotopic mass
- 209.15281224
Overview
See also: 2,6-Bis-(dimethylaminomethyl)-3-pyridinol (annotation moved to).
Names & identifiers
- Preferred name
- 2,6-Bis((dimethylamino)methyl)-3-pyridinol
- IUPAC
- 2,6-bis[(dimethylamino)methyl]pyridin-3-ol
- English name
- 2,6-Bis-(dimethylaminomethyl)-3-pyridinol
- Molecular formula
- C11H19N3O
- Molecular weight
- 209.29
Names & synonyms
2,6-bis[(dimethylamino)methyl]-3-pyridinol2,6-bis((dimethylamino)methyl)-3-pyridinolRefChem:4451882168-17-42,6-bis[(dimethylamino)methyl]pyridin-3-ol2,6-Bis((dimethylamino)methyl)pyridin-3-olNSC73721NSC-73721ChemDiv3_002008NCIStruc1_000632NCIStruc2_000477Oprea1_719897
Show more names
2,6-Bis-(dimethylaminomethyl)-3-pyridinol3-Pyridinol, 2,6-bis[(dimethylamino)methyl]-
CHEMBL1741653DTXSID70291180HMS1478L06NCI73721CCG-38216NCGC00013810NSC 73721STK500088
Database identifiers
- CAS
2168-17-4- PubChem CID
- 252256
- DTXSID
DTXSID70291180- ChEMBL
CHEMBL1741653
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 39.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 185
Physicochemical properties
- Boiling point
- 100 · 100-102 °C(Press: 1 Torr)
- Density
- 1.077 · 1.077±0.06 g/cm3(Predicted)
- pka
- 4.11 · 4.11±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 302 · H302-H315-H318-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P280-P305+P351+P338-P310
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H302-H315-H318-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P280-P305+P351+P338-P310
Suppliers
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Related reactions
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Compound notes
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