2-(Dimethylamino)-5-nitrobenzaldehyde
Basic information
- CAS
34601-40-6- Standard SMILES
CN(C)c1ccc([N+](=O)[O-])cc1C=O- InChIKey
NBISLQQKJKDSRO-UHFFFAOYSA-N- Molecular formula
- C9H10N2O3
- Average molar mass
- 194.19 g/mol
- Monoisotopic mass
- 194.06914219
Names & identifiers
- Preferred name
- 2-(Dimethylamino)-5-nitrobenzaldehyde
- IUPAC
- 2-(dimethylamino)-5-nitrobenzaldehyde
- English name
- 2-(Dimethylamino)-5-nitrobenzaldehyde
- Molecular formula
- C9H10N2O3
- Molecular weight
- 194.19
Names & synonyms
2-(dimethylamino)-5-nitrobenzaldehyde34601-40-6DTXSID50401285RefChem:253826DTXCID30352140969-555-22-(Dimethylamino)-5-nitrobenzenecarbaldehydeMFCD04085744SCHEMBL28262373SCHEMBL28886073JBA60140SBB091723
Show more names
Benzaldehyde, 2-(dimethylamino)-5-nitro-N,N-Dimethyl-5-nitroanthranilaldehyde, N,N-Dimethyl-2-formyl-4-nitroaniline
STL419290AKOS000416229KB-07232-(dimethylamino)-5-nitro-benzaldehydeSY522455CS-0259181EN300-725703H41452
Database identifiers
- CAS
34601-40-6- PubChem CID
- 4255461
- DTXSID
DTXSID50401285- EC Number
- 969-555-2
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 225
Physicochemical properties
- Melting point
- 103 · 103-105°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H312-H332
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
- HS Code
- 2922390090 · 2922390090
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, P317, 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
- hs_code
- 2922390090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
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Related reactions
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Compound notes
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