

3,3-Dimethoxypropanenitrile
Catalog No: FT-0614064
CAS No: 57597-62-3
- Molecular Formula: 115.13
- Formula Weight: C5H9NO2
- Inchl Key: JYHSJQNYYLGMEI-UHFFFAOYSA-N
- Inchl: InChI=1S/C5H9NO2/c1-7-5(8-2)3-4-6/h5H,3H2,1-2H3
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Product_Name: | 3,3-Dimethoxypropanenitrile |
---|---|
Bolling_Point: | 92.5 °C30 mm Hg(lit.) |
MF: | C5H9NO2 |
Symbol: | GHS07 |
Melting_Point: | N/A |
CAS: | 57597-62-3 |
Density: | 1.026 g/mL at 25 °C(lit.) |
FW: | 115.13000 |
Flash_Point: | 182 °F |
MF: | C5H9NO2 |
---|---|
Bolling_Point: | 92.5 °C30 mm Hg(lit.) |
Exact_Mass: | 115.06300 |
More_Info: | ['1 . Appearance Liquid ', '2 . Density(g/mL,25ºC)1001 ', '3 . Relative vapor density(g/mL,Atmosphere =1) Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC)191 ', '6 . Boiling point(ºC,08mmHg)Unknow ', '7 . Refractive indexn 20/D 1414(lit) ', '8 . Flash point(°F)182 ', '9 . Specific rotation(ºC)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC) Unknow ', '11 . Vapor pressure(kPa,25ºC)397 ', '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 Unknow'] |
PSA: | 42.25000 |
Flash_Point: | 182 °F |
Computational_Chemistry: | ['1. XlogP :-02 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 422 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :898 ', '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'] |
Density: | 1.026 g/mL at 25 °C(lit.) |
FW: | 115.13000 |
LogP: | 0.51898 |
Refractive_Index: | n20/D 1.414(lit.) |
Risk_Statements(EU): | R20/21/22 |
---|---|
Hazard_Codes: | Xn:Harmful; |
HS_Code: | 2926909090 |
Hazard_Class: | 6.1 |
Safety_Statements: | S23-S26-S28-S37/39 |
WGK_Germany: | 3 |
Warning_Statement: | P280-P305 + P351 + P338 |
Packing_Group: | I; II; III |
Symbol: | GHS07 |
Related Products
3,4-Pyrrolidinediol, 2-[(4-methoxyphenyl)methyl]-, 3-acetate, (2S,3R,4R)-
(4S)-2-[[[(2R)-2-AMino-2-(4-hydroxyphenyl)acetyl]aMino]Methyl]-5,5-diMethyl-4-thiazolidinecarboxylic Acid (Mixture of DiastereoMers)