3-Chloro-4-nitrotoluene Structure

3-Chloro-4-nitrotoluene

Chemical Properties

Melting point 24-28 °C (lit.)
Boiling point 219 °C (lit.)
Density  1.3246 (rough estimate)
refractive index  n20/D 1.564(lit.)
Flash point >230 °F
storage temp.  Sealed in dry,Room Temperature
form  Liquid After Melting
color  Clear yellow
InChI InChI=1S/C7H6ClNO2/c1-5-2-3-7(9(10)11)6(8)4-5/h2-4H,1H3
InChIKey KGSQRFPDZCBVBS-UHFFFAOYSA-N
SMILES C1([N+]([O-])=O)=CC=C(C)C=C1Cl
CAS DataBase Reference 38939-88-7(CAS DataBase Reference)
FDA UNII DSC68C64BS
NIST Chemistry Reference Benzene, 2-chloro-4-methyl-1-nitro-(38939-88-7)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P270-P301+P312+P330-P501
Hazard Codes  Xn,Xi,N
Risk Statements  22-36/37/38-20/21/22-52/53
Safety Statements  36/37/39-26-61-24/25
RIDADR  UN 3457 6.1/PG 3
WGK Germany  3
Hazard Note  Irritant
HazardClass  6.1
PackingGroup  III
HS Code  29049090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 4 Oral
NFPA 704:
1
1 0

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3-Chloro-4-nitrotoluene Spectrum