2,3-Dimethoxy-5-nitrobenzaldehyde
Basic information
- CAS
6324-49-8- Standard SMILES
COc1cc([N+](=O)[O-])cc(C=O)c1OC- InChIKey
KYKNZENWQXJPCA-UHFFFAOYSA-N- Molecular formula
- C9H9NO5
- Average molar mass
- 211.17 g/mol
- Monoisotopic mass
- 211.04807239
Names & identifiers
- Preferred name
- 2,3-Dimethoxy-5-nitrobenzaldehyde
- IUPAC
- 2,3-dimethoxy-5-nitrobenzaldehyde
- English name
- 2,3-dimethoxy-5-nitro-benzaldehyde
- Molecular formula
- C9H9NO5
- Molecular weight
- 211.17
Names & synonyms
2,3-dimethoxy-5-nitrobenzaldehyde6324-49-82,3-Dimethoxy-5-nitro-benzaldehydeNSC30097SCHEMBL2838581DTXSID20283151KYKNZENWQXJPCA-UHFFFAOYSA-NNSC-30097AKOS015996673DB-346451H57763F025156
Show more names
Benzaldehyde, 2,3-dimethoxy-5-nitro-
SR-01000293014SR-01000293014-1
Database identifiers
- CAS
6324-49-8- PubChem CID
- 232525
- DTXSID
DTXSID20283151- EC Number
- 675-160-3
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- Melting point
- 115 °C · 115 °C
- Boiling point
- 373.9 · 373.9±42.0 °C(Predicted)
- Density
- 1.312 · 1.312±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Related reactions
5 records
Compound notes
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