

2,3-DIMETHYLPHENYL ISOCYANATE
Catalog No: FT-0609721
CAS No: 1591-99-7
- Molecular Formula: 147.17
- Formula Weight: C9H9NO
- Inchl Key: KNHJIEOCVVIBIV-UHFFFAOYSA-N
- Inchl: InChI=1S/C9H9NO/c1-7-4-3-5-9(8(7)2)10-6-11/h3-5H,1-2H3
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Melting_Point: | N/A |
---|---|
CAS: | 1591-99-7 |
MF: | C9H9NO |
Flash_Point: | 199 °F |
Product_Name: | 2,3-dimethylphenyl isocyanate |
Density: | 1.059 g/mL at 25 °C(lit.) |
FW: | 147.17400 |
Bolling_Point: | 105 °C50 mm Hg(lit.) |
Refractive_Index: | n20/D 1.54(lit.) |
---|---|
Vapor_Pressure: | 0.068mmHg at 25°C |
Flash_Point: | 199 °F |
LogP: | 2.27070 |
Bolling_Point: | 105 °C50 mm Hg(lit.) |
PSA: | 29.43000 |
Molecular_Structure: | ['1 . Molar refractive index 4500 ', '2 . Molar volume (m3/mol)1490 ', '3 . Parachor (902K)3574 ', '4 . Surface tension 330 ', '5 . Dielectric constant (F/m)无可用 ', '6 . Polarizability (10 -24cm 3)1784'] |
Computational_Chemistry: | ['1. XlogP :35 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 294 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :172 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
MF: | C9H9NO |
Exact_Mass: | 147.06800 |
FW: | 147.17400 |
Density: | 1.059 g/mL at 25 °C(lit.) |
More_Info: | ['1 . Appearance Colourless Liquid 。 ', '2 . Density(g/mL,25/4℃) 1059 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC,Atmospheric pressure)105 ', '6 . Boiling point(ºC,52kPa) Unknow ', '7 . Refractive index 154 ', '8 . Flash point(ºC) 93 ', '9 . Specific rotation(º) Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC) Unknow ', '11 . Vapor pressure(kPa,25ºC) Unknow ', '12 . Saturated vapor pressure(kPa,60ºC) Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC) Unknow ', '15 . Critical pressure(KPa) Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V) Unknow ', '19 . Solubility 可Water 解'] |
Hazard_Class: | 6.1 |
---|---|
Risk_Statements(EU): | R23/25;R36/37/38;R42 |
WGK_Germany: | 3 |
RIDADR: | UN 2206 6.1/PG 3 |
Hazard_Codes: | Xn:Harmful; |
HS_Code: | 2929109000 |
Safety_Statements: | S26-S36 |
Packing_Group: | III |
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