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4-Methoxy-3-[(2-naphthyloxy)methyl]benzaldehyde

HCID 178781122
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Basic information

CAS
438531-00-1
Standard SMILES
COc1ccc(C=O)cc1COc1ccc2ccccc2c1
InChIKey
QDIZDXPFRYFCMC-UHFFFAOYSA-N
Molecular formula
C19H16O3
Average molar mass
292.3 g/mol

Names & identifiers

Preferred name
4-Methoxy-3-[(2-naphthyloxy)methyl]benzaldehyde
IUPAC
4-methoxy-3-(naphthalen-2-yloxymethyl)benzaldehyde
English name
4-Methoxy-3-(naphthalen-2-yloxymethyl)-benzaldehyde
Molecular formula
C19H16O3
Molecular weight
292.33

Names & synonyms

4-methoxy-3-[(2-naphthyloxy)methyl]benzaldehyde438531-00-14-methoxy-3-[(naphthalen-2-yloxy)methyl]benzaldehyde4-Methoxy-3-(naphthalen-2-yloxymethyl)-benzaldehydeMFCD020557464-methoxy-3-(2-naphthyloxymethyl)benzaldehyde4-Methoxy-3-((naphthalen-2-yloxy)methyl)benzaldehyde4-methoxy-3-(naphthalen-2-yloxymethyl)benzaldehydeOprea1_544421ALBB-001082BBL016177SBB020160
Show more names
ALD-N000594AKOS B006376ZINC00372104ART-CHEM-BB B006376Benzaldehyde, 4-methoxy-3-[(2-naphthalenyloxy)methyl]-
STK348939AKOS000307727VS-05194CS-0215198ST45161628EN300-228171H21236AK-968/41017833

Database identifiers

CAS
438531-00-1

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
22
Formal charge
0
Complexity
357

Physicochemical properties

Hazard Codes
Xi
HazardClass
IRRITANT

Safety & regulation

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

Safety data

hazard_code
Xi
hazard_class
IRRITANT

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Compound notes

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