Specification: |
The 2-Ethyl-3-hydroxy-6-methylpyridine hydrochloride, with its cas register number 13258-59-8, has its IUPAC Name of 2-ethyl-6-methylpyridin-3-ol hydrochloride. Besides, it has the systematic name of 3-Pyridinol, 2-ethyl-6-methyl-, hydrochloride. This chemical is usually used in drug / therapeutic agent.
The characteristics of this chemical are as following: (1)H-Bond Donor: 2 ; (2)H-Bond Acceptor: 2 ; (3)Rotatable Bond Count: 1 ; (4)Tautomer Count: 8 ; (5)Exact Mass: 173.060742 ; (6)MonoIsotopic Mass: 173.060742 ; (7)Topological Polar Surface Area: 33.1 ; (8)Heavy Atom Count: 11 ; (9)Complexity: 105 ; (10)Covalently-Bonded Unit Count: 2.
Additionally, you could obtain the molecular structure through converting the following datas:
Canonical SMILES: CCC1=C(C=CC(=N1)C)O.Cl
InChI: InChI=1S/C8H11NO.ClH/c1-3-7-8(10)5-4-6(2)9-7;/h4-5,10H,3H2,1-2H3;1H
InChIKey: KZUIXWYHQJZUOK-UHFFFAOYSA-N
Below are the toxicity information of this chemical:
Organism |
Test Type |
Route |
Reported Dose (Normalized Dose) |
Effect |
Source |
mouse |
LD50 |
intraperitoneal |
310mg/kg (310mg/kg) |
|
Drugs of the Future. Vol. 12, Pg. 754, 1987. |
mouse |
LD50 |
intravenous |
205mg/kg (205mg/kg) |
|
Drugs of the Future. Vol. 12, Pg. 754, 1987 |
|