5-Chloro-2-((4-methylphenyl)methoxy)benzaldehyde
Basic information
- CAS
590360-23-9- Standard SMILES
Cc1ccc(COc2ccc(Cl)cc2C=O)cc1- InChIKey
AJWAGBRTJHZGCV-UHFFFAOYSA-N- Molecular formula
- C15H13ClO2
- Average molar mass
- 260.71 g/mol
- Monoisotopic mass
- 260.0604073
Names & identifiers
- Preferred name
- 5-Chloro-2-((4-methylphenyl)methoxy)benzaldehyde
- IUPAC
- 5-chloro-2-[(4-methylphenyl)methoxy]benzaldehyde
- English name
- 5-Chloro-2-[(4-methylbenzyl)oxy]benzaldehyde
- Molecular formula
- C15H13ClO2
- Molecular weight
- 260.72
Names & synonyms
590360-23-95-chloro-2-[(4-methylphenyl)methoxy]benzaldehyde5-Chloro-2-((4-methylphenyl)methoxy)benzaldehydeRefChem:3023085-chloro-2-[(4-methylbenzyl)oxy]benzaldehyde5-Chloro-2-((4-methylbenzyl)oxy)benzaldehydeMFCD03422439DTXSID60358392ALBB-001262BBL014012STK039440AKOS000287770
Show more names
ZINC00468148Benzaldehyde, 5-chloro-2-[(4-methylphenyl)methoxy]-5-chloro-2-[(4-methylbenzyl)oxy]benzaldehyde(SALTDATA: FREE)
5-chloro-2-(p-tolylmethoxy)benzaldehydeNCGC00338711-01VS-04110CS-0315785ST50845690H21365AB01330900-02F307574
Database identifiers
- CAS
590360-23-9- PubChem CID
- 892242
- DTXSID
DTXSID60358392
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Boiling point
- 398.9 · 398.9±32.0 °C(Predicted)
- Density
- 1.218 · 1.218±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
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Related reactions
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Compound notes
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