

2-CHLORO-4-METHYLPHENYL ISOTHIOCYANATE
Catalog No: FT-0611785
CAS No: 57878-93-0
- Molecular Formula: 183.66
- Formula Weight: C8H6ClNS
- Inchl Key: UIZZXGXTVVWRED-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H6ClNS/c1-6-2-3-8(10-5-11)7(9)4-6/h2-4H,1H3
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Bolling_Point: | 138ºC/20mm |
---|---|
MF: | C8H6ClNS |
Density: | 1.18g/cm3 |
FW: | 183.65800 |
Product_Name: | 2-chloro-1-isothiocyanato-4-methylbenzene |
CAS: | 57878-93-0 |
Flash_Point: | 127.3ºC |
Melting_Point: | N/A |
Bolling_Point: | 138ºC/20mm |
---|---|
LogP: | 3.38270 |
More_Info: | ['1 . Appearance Unknow ', '2 . Density(g/cm3,20℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)Unknow ', '5 . Boiling point(ºC, Atmospheric pressure)138 ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)Unknow ', '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 (25℃)Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Water Unknow'] |
Computational_Chemistry: | ['1. XlogP :43 ', '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 444 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :177 ', '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'] |
Exact_Mass: | 182.99100 |
MF: | C8H6ClNS |
Density: | 1.18g/cm3 |
Refractive_Index: | 1.583 |
PSA: | 44.45000 |
Flash_Point: | 127.3ºC |
Molecular_Structure: | ['1 . Molar refractive index 5165 ', '2 . Molar volume (m3/mol)1545 ', '3 . Parachor (902K)3783 ', '4 . Surface tension 359 ', '5 . Polarizability 2047'] |
FW: | 183.65800 |
Safety_Statements: | S26-S36/37/39 |
---|---|
HS_Code: | 2930909090 |
Hazard_Codes: | Xn:Harmful; |
Risk_Statements(EU): | R20/21/22;R36/37/38 |
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)