Basic information
- CAS
529513-66-4- Standard SMILES
COc1cc(C=O)ccc1OCc1c(Cl)cccc1Cl- InChIKey
GYXPQXNHHNIMSS-UHFFFAOYSA-N- Molecular formula
- C15H12Cl2O3
- Average molar mass
- 311.2 g/mol
- Monoisotopic mass
- 310.0163496
Names & identifiers
- Preferred name
- 4-[(2,6-Dichlorobenzyl)oxy]-3-methoxybenzaldehyde
- IUPAC
- 4-[(2,6-dichlorophenyl)methoxy]-3-methoxybenzaldehyde
- English name
- 4-[(2,6-Dichlorobenzyl)oxy]-3-methoxybenzaldehyde
- Molecular formula
- C15H12Cl2O3
- Molecular weight
- 311.16
Names & synonyms
4-[(2,6-dichlorobenzyl)oxy]-3-methoxybenzaldehyde529513-66-44-[(2,6-dichlorophenyl)methoxy]-3-methoxybenzaldehyde4-((2,6-Dichlorobenzyl)oxy)-3-methoxybenzaldehydeMFCD01590271Oprea1_154826ZERO/004744OTAVA-BB BB7018801976DTXSID80352776AKOS B014224ART-CHEM-BB B014224ALBB-001343
Show more names
Benzaldehyde, 4-[(2,6-dichlorophenyl)methoxy]-3-methoxy-
BBL016403SBB012920STK422088ZINC00151804AKOS000273781VS-05313ST4128552CS-0313496
Database identifiers
- CAS
529513-66-4- PubChem CID
- 735461
- DTXSID
DTXSID80352776
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
- 20
- Formal charge
- 0
- Complexity
- 303
Physicochemical properties
- storage temp.
- 2 · 2-8°C, stored under nitrogen
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- 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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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