Basic information
- CAS
730949-79-8- Standard SMILES
COc1cccc(C=O)c1OC(F)F- InChIKey
DDAGGCKTGNIEIG-UHFFFAOYSA-N- Molecular formula
- C9H8F2O3
- Average molar mass
- 202.15 g/mol
- Monoisotopic mass
- 202.04415044
Names & identifiers
- Preferred name
- 2-(Difluoromethoxy)-3-methoxybenzaldehyde
- IUPAC
- 2-(difluoromethoxy)-3-methoxybenzaldehyde
- English name
- 2-Difluoromethoxy-3-methoxy-benzaldehyde
- Molecular formula
- C9H8F2O3
- Molecular weight
- 202.15
Names & synonyms
2-(difluoromethoxy)-3-methoxybenzaldehyde2-Difluoromethoxy-3-methoxy-benzaldehyde730949-79-8MFCD04621474SCHEMBL4132573YQF1363DTXSID201272866FEB94979SBB011022STL509199AKOS0001114972-difluoromethoxy-3-methoxybenzaldehyde
Show more names
TIMTEC-BB SBB011022ASINEX-REAG BAS 11567590Benzaldehyde, 2-(difluoromethoxy)-3-methoxy-2-(difluoromethoxy)-3-methoxy-5-methylbenzaldehyde
2-(difluoromethoxy)-3-methoxy-benzaldehydeCS-0220377ST45255988EN300-06514G28459Z55671945
Database identifiers
- CAS
730949-79-8- PubChem CID
- 2393501
- DTXSID
DTXSID201272866
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 187
Physicochemical properties
- 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
Suppliers4 total
安徽合诺生物科技有限公司0555-2761852
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
安徽合诺生物科技有限公司18455579438
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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