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| CAS No.: | 100-23-2 | ||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Name: | N,N-DIMETHYL-4-NITROANILINE | ||||||||||||||
| Article Data: | 193 | ||||||||||||||
| Molecular Structure: | |||||||||||||||
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| Formula: | C8H10N2O2 | ||||||||||||||
| Molecular Weight: | 166.18 | ||||||||||||||
| Synonyms: | 1-(Dimethylamino)-4-nitrobenzene;1-Dimethylamino-4-nitro-benzen;4-(Dimethylamino)nitrobenzene;4-Nitrodimethylaniline;Aniline, N,N-dimethyl-p-nitro-;Benzenamine,N,N-dimethyl-4-nitro-;Dimethyl-(4-nitro-phenyl)-amine;n,n-dimethyl-4-nitro-benzenamin | ||||||||||||||
| Density: | 1.193g/cm3 | ||||||||||||||
| Melting Point: | 163-165 °C | ||||||||||||||
| Boiling Point: | 287.6°Cat760mmHg | ||||||||||||||
| Flash Point: | 127.7°C | ||||||||||||||
| Solubility: | Soluble in dichloromethane. Insoluble in water. Solubility in hot methanol (almost transparency). | ||||||||||||||
| Appearance: | Yellow Solid | ||||||||||||||
| Hazard Symbols: |
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| Risk Codes: | 36/37/38-23/24/25 | ||||||||||||||
| Safety: |
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| PSA: | 49.06000 | ||||||||||||||
| LogP: | 2.18400 | ||||||||||||||
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Chemistry
Molecular Structure of N,N-Dimethyl-4-nitroaniline (CAS NO.100-23-2):
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IUPAC Name: N,N-Dimethyl-4-nitroaniline
Molecular Formula: C8H10N2O2
Molecular Weight: 166.18
EINECS: 202-832-1
log P (octanol-water): 2.27
Index of Refraction: 1.591
Molar Refractivity: 47.11 cm3
Molar Volume: 139.2 cm3
Surface Tension: 47 dyne/cm
Density: 1.193 g/cm3
Melting Point: 164 °C
Flash Point: 127.7 °C
Enthalpy of Vaporization: 52.67 kJ/mol
Boiling Point: 287.6 °C at 760 mmHg
Vapour Pressure: 0.00247 mmHg at 25 °C
Water Solubility: 738 mg/L at 25 °C
Henry's Law Constant: 3.38E-07 atm-m3/mole at 25 °C
Atmospheric OH Rate Constant: 4.88E-11 cm3/molecule-sec at 25 °C
Appearance: Yellow Solid
Product Categories: Aromatics Compounds; Aromatics; Intermediates
Canonical SMILES: CN(C)C1=CC=C(C=C1)[N+](=O)[O-]
InChI: InChI=1S/C8H10N2O2/c1-9(2)7-3-5-8(6-4-7)10(11)12/h3-6H,1-2H3
InChIKey: QJAIOCKFIORVFU-UHFFFAOYSA-N
Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| rat | LD | oral | > 500mg/kg (500mg/kg) | National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 11, 1953. |
Safety Profile
Safety Information of N,N-Dimethyl-4-nitroaniline (CAS NO.100-23-2):
Hazard Codes:
T
Risk Statements: 36/37/38-23/24/25
R36/37/38:Irritating to eyes, respiratory system and skin.
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed.
Safety Statements: 45-36/37/39-26
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
RIDADR: 2811
RTECS: BX7035000
HazardClass: 6.1
PackingGroup: III
Specification
N,N-Dimethyl-4-nitroaniline (CAS NO.100-23-2), its Synonyms are 1-(Dimethylamino)-4-nitrobenzene ; 4-(Dimethylamino)nitrobenzene ; 4-Nitro-N,N-dimethylaniline ; 4-Nitrodimethylaniline ; p-(Dimethylamino)nitrobenzene ; p-Nitro-N,N-dimethylaniline ; p-Nitrodimethylaniline ; Aniline, N,N-dimethyl-p-nitro- ; Benzenamine, N,N-dimethyl-4-nitro- ; N,N-Dimethyl-p-nitroaniline .