Pyridine, 3-ethyl-, 1-oxide

HCID 84685
NotesReactions
Substructure searchFind similar structures

Basic information

CAS
14906-62-8
Standard SMILES
CCc1ccc[n+]([O-])c1
InChIKey
WHLDRJCCCXVISS-UHFFFAOYSA-N
Molecular formula
C7H9NO
Average molar mass
123.15 g/mol
Monoisotopic mass
123.06841391

Names & identifiers

Preferred name
Pyridine, 3-ethyl-, 1-oxide
IUPAC
3-ethyl-1-oxidopyridin-1-ium
English name
3-Ethylpyridine 1-oxide
Molecular formula
C7H9NO
Molecular weight
123.15

Names & synonyms

14906-62-8Pyridine, 3-ethyl-, 1-oxideDTXSID50164161RefChem:177588DTXCID80866523-Ethylpyridine 1-oxide3-ethyl-1-oxidopyridin-1-ium3-Ethylpyridine1-oxide3-Ethylpyridine N-oxideSCHEMBL1026110SCHEMBL14844558WHLDRJCCCXVISS-UHFFFAOYSA-N
Show more names
Pyridine, 3-ethyl-,1-oxide
MFCD183796793-Ethyl-1-oxo-1lambda~5~-pyridineAKOS016007197SB53786SY460012H63134

Database identifiers

CAS
14906-62-8
PubChem CID
84685
DTXSID
DTXSID50164161
Nikkaji
J101.115D

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
25.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
9

Physicochemical properties

Boiling point
147 · 147-149 °C(Press: 1 Torr)
Density
0.99 · 0.99±0.1 g/cm3(Predicted)
pka
1 · pK1:-0.965(+1) (25°C)

Chemistry & industry

Upstream & downstream products

Downstream products

Suppliers16 total

武汉布林科技有限公司3456065315 13260619011 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
济南精合医药科技有限公司0531-88811783 · [email protected]

Related reactions

6 records
New reaction record

Compound notes

Loading…