Isonicotinaldehyde O-methyloxime

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Basic information

CAS: 57980-42-4
Standard SMILES: CON=Cc1ccncc1
InChIKey: CPJAUCNNLLTZAX-UHFFFAOYSA-N
Molecular formula: C7H8N2O
Average molar mass: 136.15 g/mol
Monoisotopic mass: 136.06366288

Overview

See also: 4-Pyridinecarboxaldehyde, O-methyloxime (annotation moved to).

Names & identifiers

Preferred name: Isonicotinaldehyde O-methyloxime
IUPAC: N-methoxy-1-pyridin-4-ylmethanimine

Names & synonyms

Isonicotinaldehyde O-methyloximeCPJAUCNNLLTZAX-UHFFFAOYSA-NDTXSID601280663N-methoxy-1-pyridin-4-ylmethanimineN-Methoxy-1-(pyridin-4-yl)methanimineDB-326503

Database identifiers

CAS: 57980-42-4
PubChem CID: 93906
DTXSID: DTXSID601280663

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 34.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 10
Formal charge: 0
Complexity: 108

Related reactions

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Compound notes

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