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6-Methyl-2-pyridinealdoxime O-benzyl ether

HCID 9568071
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Basic information

CAS
70289-35-9
Standard SMILES
Cc1cccc(/C=N/OCc2ccccc2)n1
InChIKey
CISKZGJZNWBKSC-XNTDXEJSSA-N
Molecular formula
C14H14N2O
Average molar mass
226.27 g/mol
Monoisotopic mass
226.11061307

Names & identifiers

Preferred name
6-Methyl-2-pyridinealdoxime O-benzyl ether
IUPAC
(E)-1-(6-methyl-2-pyridinyl)-N-phenylmethoxymethanimine
English name
6-Methyl-2-pyridinealdoxime O-benzyl ether
Molecular formula
C14H14N2O
Molecular weight
226.27

Names & synonyms

6-METHYL-2-PYRIDINEALDOXIME O-BENZYL ETHERRefChem:543850654-594-770289-35-92-Pyridinecarboxaldehyde, 6-methyl-, O-(phenylmethyl)oxime(E)-1-(6-methylpyridin-2-yl)-N-phenylmethoxymethanimine6-Methylpicolinaldehyde O-benzyl oximeAKOS024323048NSC 163373(E)-(Benzyloxy)[(6-methylpyridin-2-yl)methylidene]amine

Database identifiers

CAS
70289-35-9
PubChem CID
9568071
EC Number
654-594-7

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
34.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
236

Physicochemical properties

Boiling point
365.8 · 365.8±52.0 °C(Predicted)
Density
1.04 · 1.04±0.1 g/cm3(Predicted)
pka
3.74 · 3.74±0.19(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H319-H335-H315
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H319-H335-H315
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501-P264-P280-P305+P351+P338-P337+P313P

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Compound notes

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