METHYL TRANS-2-HEXENOATE,98

Catalog No: FT-0628815

CAS No: 13894-63-8

Chemical Name: METHYL TRANS-2-HEXENOATE,98
Molecular Formula: C7H12O2
Molecular Weight: 128.17 g/mol
InChI Key: GFUGBRNILVVWIE-AATRIKPKSA-N
InChI: InChI=1S/C7H12O2/c1-3-4-5-6-7(8)9-2/h5-6H,3-4H2,1-2H3/b6-5+

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:	Methyl Trans-2-Hexenoate
Flash_Point:	45.4ºC
Melting_Point:	N/A
FW:	128.16900
Density:	N/A
CAS:	13894-63-8
Bolling_Point:	149.3ºC at 760mmHg
MF:	C7H12O2

Molecular_Structure:	['1. Molar refractive index 3631 ', '2. Molar volume 1411 ', '3. Parachor （902K）3225 ', '4. Surface tension 272 ', '5. Dielectric constant N/A ', '6. Polarizability 1439 ', '7. Single isotope mass 12808373 Da ', '8. Nominal mass 128 Da ', '9. Average mass 128169 Da']
LogP:	1.51570
Flash_Point:	45.4ºC
Refractive_Index:	1.433
FW:	128.16900
Bolling_Point:	149.3ºC at 760mmHg
Computational_Chemistry:	['1 . XlogP 19 ', '2 . Hydrogen Bond Donor Count 0 ', '3 . Hydrogen Bond Acceptor Count 2 ', '4 . Rotatable Bond Count 4 ', '5 . TPSA 263 ', '6 . Heavy Atom Count 9 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 106 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 1 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
PSA:	26.30000
MF:	C7H12O2
More_Info:	['1 . Appearance Colourless 的Liquid ', '2 . Density（g/mL,25/4℃）0915 ', '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）57-58 ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）45 ', '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 不能拌and 的or 难以拌and ']
Vapor_Pressure:	4.06mmHg at 25°C
Exact_Mass:	128.08400