N,N-Dimethyl-4-[(E)-2-nitroethenyl]aniline
Basic information
- CAS
2604-08-2- Standard SMILES
CN(C)c1ccc(/C=C/[N+](=O)[O-])cc1- InChIKey
RIXCESCQOUSSJX-BQYQJAHWSA-N- Molecular formula
- C10H12N2O2
- Average molar mass
- 192.21 g/mol
- Monoisotopic mass
- 192.08987763
Names & identifiers
- Preferred name
- N,N-Dimethyl-4-[(E)-2-nitroethenyl]aniline
- IUPAC
- N,N-dimethyl-4-[(E)-2-nitroethenyl]aniline
- English name
- N,N-Dimethyl-N-{4-[2-nitrovinyl]phenyl}amine
- Molecular formula
- C10H12N2O2
- Molecular weight
- 192.21
Names & synonyms
(E)-N,N-dimethyl-4-(2-nitrovinyl)aniline2604-08-222568-06-5N,N-Dimethyl-4-[(E)-2-nitroethenyl]anilineN,N-Dimethyl-4-(2-nitrovinyl)anilineN,N-dimethyl-N-{4-[2-nitrovinyl]phenyl}amineMLS000589585N,N-Dimethyl-4-(2-nitroethenyl)benzenamineMFCD00156298SMR000212951Dimethyl-[4-((E)-2-nitro-vinyl)-phenyl]-amineBenzenamine, N,N-dimethyl-4-[(1E)-2-nitroethenyl]-
Show more names
4-DIMETHYLAMINO-BETA-NITROSTYRENEBenzenamine, N,N-dimethyl-4-(2-nitroethenyl)-
F0486-1366[4-((1E)-2-nitrovinyl)phenyl]dimethylamine4-(Dimethylamino)-b-nitrostyreneNSC3454p-Dimethylamino-b-nitrostyrenecid_774089SCHEMBL1479820CHEMBL1427492
Database identifiers
- CAS
2604-08-2- PubChem CID
- 774089
- DTXSID
DTXSID20875954- ChEMBL
CHEMBL1427492- EC Number
- 631-082-1
- Nikkaji
- J464.857I、J676.664A
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 213
Experimental & physicochemical properties
LogP2.67
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Suppliers
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Related reactions
0 records
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Compound notes
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