Basic information
- CAS
13287-63-3- Standard SMILES
Cc1cc(C)nc(CCO)c1- InChIKey
RXQPCTUALPFOSW-UHFFFAOYSA-N- Molecular formula
- C9H13NO
- Average molar mass
- 151.21 g/mol
- Monoisotopic mass
- 151.09971404
Names & identifiers
- Preferred name
- 2-(4,6-Dimethylpyridin-2-yl)ethan-1-ol
- IUPAC
- 2-(4,6-dimethyl-2-pyridinyl)ethanol
- English name
- 2-PYRIDINEETHANOL,4,6-DIMETHYL-
- Molecular formula
- C9H13NO
- Molecular weight
- 151.21
Names & synonyms
13287-63-32-(4,6-dimethylpyridin-2-yl)ethan-1-olRefChem:456038982-428-62-(4,6-dimethylpyridin-2-yl)ethanol2-pyridineethanol,4,6-dimethyl-4,6-Dimethyl-2-pyridineethanol2-(4,6-Dimethyl-2-pyridyl)ethanolSCHEMBL11699836AKOS006295346CS-0239954EN300-221670
Database identifiers
- CAS
13287-63-3- PubChem CID
- 269754
- EC Number
- 982-428-6
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 33.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 116
Physicochemical properties
- Melting point
- 51 · 51-55 °C
- Boiling point
- 87 °C · 87 °C(Press: 15 Torr)
- Density
- 0.943 g/cm3 · 0.943 g/cm3
- pka
- 14.47 · 14.47±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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