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ETHYL 2-ISOCYANATO-4-METHYLVALERATE

Catalog No: FT-0625959

CAS No: 64505-10-8

Chemical Name: ETHYL 2-ISOCYANATO-4-METHYLVALERATE
Molecular Formula: C9H15NO3
Molecular Weight: 185.22
InChI Key: SSTQICMSRVMLQN-UHFFFAOYSA-N
InChI: InChI=1S/C9H15NO3/c1-4-13-9(12)8(10-6-11)5-7(2)3/h7-8H,4-5H2,1-3H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	ethyl 2-isocyanato-4-methylvalerate
Flash_Point:	N/A
Melting_Point:	N/A
FW:	185.22000
Density:	N/A
CAS:	64505-10-8
Bolling_Point:	92-93ºC 8mm
MF:	C9H15NO3

Molecular_Structure:	['1 . Molar refractive index 4961 ', '2 . Molar volume （m3/mol）1805 ', '3 . Parachor （902K）4295 ', '4 . Surface tension 320 ', '5 . Polarizability 1966']
LogP:	1.30000
Refractive_Index:	1.43
FW:	185.22000
Bolling_Point:	92-93ºC 8mm
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 557 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :207 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
PSA:	55.73000
MF:	C9H15NO3
More_Info:	['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '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 Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 可Water 解。']
Exact_Mass:	185.10500