Product Name

  • Name

    4-Nitrophenyl isocyanate

  • EINECS 202-836-3
  • CAS No. 100-28-7
  • Article Data74
  • CAS DataBase
  • Density 1.32 g/cm3
  • Solubility Insoluble in water.
  • Melting Point 56-59 °C(lit.)
  • Formula C7H4N2O3
  • Boiling Point 270.4 °C at 760 mmHg
  • Molecular Weight 164.12
  • Flash Point 121.2 °C
  • Transport Information UN 2206
  • Appearance yellow crystalline solid
  • Safety 22-26-36/37/39-45
  • Risk Codes 20/21/22-36/37/38-42
  • Molecular Structure Molecular Structure of 100-28-7 (4-Nitrophenyl isocyanate)
  • Hazard Symbols HarmfulXn
  • Synonyms Isocyanicacid, p-nitrophenyl ester (6CI,7CI,8CI);1-Isocyanato-4-nitrobenzene;1-Nitro-4-isocyanatobenzene;NSC 9800;p-Nitrophenylisocyanate;
  • PSA 75.25000
  • LogP 2.08530

4-Nitrophenyl isocyanate Chemical Properties

IUPAC: 1-isocyanato-4-nitrobenzene .
Molecular Formula: C7H4N2O3
Molecular Weight: 164.12g/mol
Melting Point: 56-59 oC(lit.)
Boiling Point: 137-138 oC at 11 mm Hg(lit.)
Flash Point: >110 oC
Storage temp.: 2-8 oC
Sensitive: Moisture Sensitive 
Index of Refraction: 1.589
Molar Refractivity: 41.81 cm3
Molar Volume: 124 cm3
Polarizability: 16.57×10-24cm3
Surface Tension: 56.9 dyne/cm
Density: 1.32 g/cm3
Enthalpy of Vaporization: 50.86 kJ/mol
Vapour Pressure: 0.00684 mmHg at 25 oC
The synonyms of  4-Nitrophenyl isocyanate (100-28-7) are p-Nitrophenyl isocyanate ; Timtec-bb sbb006628 ; 1-Isocyanato-4-nitro-benzen ; Ai3-28253 ; Benzene,1-isocyanato-4-nitro- ; Isocyanic acid, P-Nitrophenyl ester ; Isocyanicacid,p-nitrophenylester ; Isocyanic acid 4-nitrophenyl ester .
The stucture of 4-Nitrophenyl isocyanate (100-28-7) is 

4-Nitrophenyl isocyanate Uses

 4-Nitrophenyl isocyanate (100-28-7) is mainly used as medicine and pesticide intermediate.

4-Nitrophenyl isocyanate Toxicity Data With Reference

1.    

orl-rat LD50:1600 mg/kg

    NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. OTS0528342 .
2.    

ipr-rat LD50:100 mg/kg

    NTIS**    National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) No. OTS0528342 .

4-Nitrophenyl isocyanate Safety Profile

A poison by intraperitoneal route. Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx.
 

Hazard Codes: Xn
Risk Statements: 20/21/22-36/37/38-42 
20/21/22: Harmful by inhalation, in contact with skin and if swallowed 
36/37/38: Irritating to eyes, respiratory system and skin 
42: May cause sensitization by inhalation
Safety Statements: 22-26-36/37/39-45 
22: Do not breathe dust 
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
36/37/39: Wear suitable protective clothing, gloves and eye/face protection 
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
RIDADR: 2206
WGK Germany: 3
RTECS: DA3692500
F: 10-19-21 
F 10: Keep under argon.
F 19: Lachrymator.
F 21: Sensitive to humidity.
HazardClass: 6.1(b)
PackingGroup: III

4-Nitrophenyl isocyanate Specification

 4-Nitrophenyl isocyanate (100-28-7) is yellow crystalline solid.

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