1,3,5-Trimethoxy-2-nitrobenzene

IUPAC Name: 1,3,5-Trimethoxy-2-nitrobenzene
Synonyms of 1,3,5-Trimethoxy-2-nitrobenzene (CAS NO.14227-18-0): 2,4,6-Trimethoxynitrobenzene ; Benzene, 1,3,5-trimethoxy-2-nitro-
CAS NO: 14227-18-0
Molecular Formula: C₉H₁₁NO₅
Molecular Weight: 213.19
Molecular Structure:
H bond acceptors: 6
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 73.51 Å²
Index of Refraction: 1.521
Molar Refractivity: 52.83 cm³
Molar Volume: 173.2 cm³
Surface Tension: 38.9 dyne/cm
Density: 1.23 g/cm³
Flash Point: 169.9 °C
Enthalpy of Vaporization: 57.89 kJ/mol
Boiling Point: 357.3 °C at 760 mmHg
Vapour Pressure: 5.67E-05 mmHg at 25°C
Melting Point: 149-151 °C
Appearance: 1,3,5-Trimethoxy-2-nitrobenzene (CAS NO.14227-18-0) is yellow crystalline powder.
SMILES: [O-][N+](=O)c1c(OC)cc(OC)cc1OC
InChI: InChI=1/C9H11NO5/c1-13-6-4-7(14-2)9(10(11)12)8(5-6)15-3/h4-5H,1-3H3
InChIKey: VWYAWLZEMLQGJH-UHFFFAOYAP
Std. InChI: InChI=1S/C9H11NO5/c1-13-6-4-7(14-2)9(10(11)12)8(5-6)15-3/h4-5H,1-3H3
Std. InChIKey: VWYAWLZEMLQGJH-UHFFFAOYSA-N
Product Categories of 1,3,5-Trimethoxy-2-nitrobenzene (CAS NO.14227-18-0): Aromatic Ethers

Hazard Codes: Xi
Hazard Note: Irritant

General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media: Use water spray, dry chemical, carbon dioxide, or chemical foam. 
Handling: Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage: Store1,3,5-Trimethoxy-2-nitrobenzene (CAS NO.14227-18-0) in a cool, dry place. Store in a tightly closed container.