4-(Dimethoxymethyl)pyridine

HCID 642853

Notes Reactions

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Basic information

Standard SMILES: COC(OC)c1ccncc1
InChIKey: KNMBFLDRNFTKHE-UHFFFAOYSA-N
Molecular formula: C8H11NO2
Average molar mass: 153.18 g/mol
Monoisotopic mass: 153.07897859

Names & identifiers

Preferred name: 4-(Dimethoxymethyl)pyridine
IUPAC: 4-(dimethoxymethyl)pyridine

Names & synonyms

4-(dimethoxymethyl)pyridine82736-91-24-dimethoxymethyl-pyridine4-dimethoxymethylpyridineSCHEMBL2646405SCHEMBL6630935SCHEMBL8557900pyridine, 4-(dimethoxymethyl)-KNMBFLDRNFTKHE-UHFFFAOYSA-NALBB-033144LS-12489H46774

Show more names

InChI=1/C8H11NO2/c1-10-8(11-2)7-3-5-9-6-4-7/h3-6,8H,1-2H

Database identifiers

PubChem CID: 642853

Properties

Computed structural properties

XLogP: 0.5
Topological polar surface area: 31.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 98

Related reactions

6 records

New reaction record

HRID 659947As productuspto-grants-2011_12

HRID 659948As reactantuspto-grants-2011_12

HRID 719750As productuspto-grants-2006_11

HRID 1575841As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)

HRID 1831840As productuspto-grants-2006_06

HRID 2127977As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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