3-Nitrobenzonitrile Structure

3-Nitrobenzonitrile

Chemical Properties

Melting point 114-117 °C(lit.)
Boiling point 165 °C (21 mmHg)
Density  0.33 g/cm3 (20℃)
refractive index  1.5300 (estimate)
Flash point 165°C/21mm
storage temp.  Store below +30°C.
solubility  very soluble in Ether
form  Crystalline Powder or Needles
color  Yellow
BRN  637674
InChI InChI=1S/C7H4N2O2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H
InChIKey RUSAWEHOGCWOPG-UHFFFAOYSA-N
SMILES C(#N)C1=CC=CC([N+]([O-])=O)=C1
CAS DataBase Reference 619-24-9(CAS DataBase Reference)
EWG's Food Scores 1
NIST Chemistry Reference Benzonitrile, 3-nitro-(619-24-9)
EPA Substance Registry System Benzonitrile, 3-nitro- (619-24-9)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302+H312+H332
Precautionary statements P261-P264-P280-P301+P312-P302+P352+P312-P304+P340+P312
Hazard Codes  Xn,T,Xi
Risk Statements  20/22-20/21/22-23/24/25
Safety Statements  22-24/25-36/37-45-36/37/39-26
RIDADR  UN 3439 6.1/PG 2
WGK Germany  3
RTECS  DI4900000
Hazard Note  Irritant
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  III
HS Code  29269095
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
1
3 0

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