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2364-75-2 molecular structure
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2-ethyl-6-methylpyridin-3-ol

ChemBase ID: 67919
Molecular Formular: C8H11NO
Molecular Mass: 137.17904
Monoisotopic Mass: 137.08406398
SMILES and InChIs

SMILES:
c1(c(ccc(n1)C)O)CC
Canonical SMILES:
CCc1nc(C)ccc1O
InChI:
InChI=1S/C8H11NO/c1-3-7-8(10)5-4-6(2)9-7/h4-5,10H,3H2,1-2H3
InChIKey:
JPGDYIGSCHWQCC-UHFFFAOYSA-N

Cite this record

CBID:67919 http://www.chembase.cn/molecule-67919.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-ethyl-6-methylpyridin-3-ol
IUPAC Traditional name
2-ethyl-6-methylpyridin-3-ol
Synonyms
2-Ethyl-3-hydroxy-6-methylpyridine
Emoxipine
Emoxypie
Epigid
6-Methyl-2-ethyl-3-hydroxypyridine
2-ethyl-6-methyl-3-pyridinol
2-Ethyl-6-Methyl-3-hydroxypyridine
CAS Number
2364-75-2
MDL Number
MFCD00462409
PubChem SID
162033654
PubChem CID
114681
Chemspider ID
102688
Wikipedia Title
6-Methyl-2-ethyl-3-hydroxypyridine

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 10.04776  H Acceptors
H Donor LogD (pH = 5.5) 0.4303791 
LogD (pH = 7.4) 1.3637275  Log P 1.4152843 
Molar Refractivity 39.6919 cm3 Polarizability 15.403638 Å3
Polar Surface Area 33.12 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Pharmacology Properties Product Information Bioassay(PubChem)
Melting Point
136-138°C expand Show data source
170-172 °C (338-341.6°F) expand Show data source
Storage Warning
IRRITANT expand Show data source
Irritant expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source
Admin Routes
Oral expand Show data source
Purity
95+% expand Show data source
97% expand Show data source

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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