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2-Ethyl-6-methylisonicotinic acid ethyl ester

HCID 66933367
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Basic information

Standard SMILES
CCOC(=O)c1cc(C)nc(CC)c1
InChIKey
OZTICPLETDDEGM-UHFFFAOYSA-N
Molecular formula
C11H15NO2
Average molar mass
193.24 g/mol

Names & identifiers

Preferred name
2-Ethyl-6-methylisonicotinic acid ethyl ester
IUPAC
ethyl 2-ethyl-6-methylpyridine-4-carboxylate

Names & synonyms

1122091-59-12-ethyl-6-methylisonicotinic acid ethyl esterethyl 2-ethyl-6-methylpyridine-4-carboxylateethyl 2-ethyl-6-methylisonicotinateMFCD26387772SCHEMBL1178800OZTICPLETDDEGM-UHFFFAOYSA-NAKOS0376457042-ethyl-6-methylisonicotinicacidethylesterAS-62414DB-3384152-ethyl-6-methyl-isonicotinic acid ethyl ester
Show more names
ethyl 2-ethyl-6-methyl-pyridine-4-carboxylateW16037

Database identifiers

PubChem CID
66933367

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
39.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
14
Formal charge
0
Complexity
194

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Related reactions

2 records
New reaction record
HRID 1545725 reaction equation
HRID 1545725As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1908826 reaction equation
HRID 1908826As reactantuspto-grants-2013_12

Compound notes

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