2-Fluoro-3,6-dimethoxybenzaldehyde
Basic information
- CAS
783342-33-6- Standard SMILES
COc1ccc(OC)c(C=O)c1F- InChIKey
LNPHQRXMWZSAHH-UHFFFAOYSA-N- Molecular formula
- C9H9FO3
- Average molar mass
- 184.16 g/mol
- Monoisotopic mass
- 184.05357231
Names & identifiers
- Preferred name
- 2-Fluoro-3,6-dimethoxybenzaldehyde
- IUPAC
- 2-fluoro-3,6-dimethoxybenzaldehyde
- English name
- 2-fluoro-3,6-dimethoxybenzaldehyde
- Molecular formula
- C9H9FO3
- Molecular weight
- 184.16
Names & synonyms
2-FLUORO-3,6-DIMETHOXYBENZALDEHYDE783342-33-6DTXSID50442032RefChem:260849DTXCID203928533,6-Dimethoxy-2-fluorobenzaldehydeMFCD19439911Benzaldehyde, 2-fluoro-3,6-dimethoxy-2-fluoro-3,6-dimethoxy-benzaldehydeSCHEMBL1478225LNPHQRXMWZSAHH-UHFFFAOYSA-NIGB34233
Show more names
DB-330314CS-0131632E91855
Database identifiers
- CAS
783342-33-6- PubChem CID
- 10583615
- DTXSID
DTXSID50442032- EC Number
- 171-904-1
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Boiling point
- 284.5 · 284.5±35.0 °C(Predicted)
- Density
- 1.201 · 1.201±0.06 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- Appearance
- pale yellow solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 303 · H303-H320
- Precautionary statements
- 312 · P312-P264-P305+P351+P338-P337+P313
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
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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H303-H320
- Precautionary statements
- P312-P264-P305+P351+P338-P337+P313
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…