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ethyl 3-(2-iodophenyl)-3-oxopropanoate

Catalog No: FT-0727811

CAS No: 90034-85-8

Chemical Name: ethyl 3-(2-iodophenyl)-3-oxopropanoate
Molecular Formula: C11H11IO3
Molecular Weight: 318.11
InChI Key: RMXYWHBYIQLPGY-UHFFFAOYSA-N
InChI: InChI=1S/C11H11IO3/c1-2-15-11(14)7-10(13)8-5-3-4-6-9(8)12/h3-6H,2,7H2,1H3

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

Bolling_Point:	340.3ºC at 760mmHg
CAS:	90034-85-8
MF:	C11H11IO3
Density:	1.622g/cm3
Melting_Point:	N/A
Product_Name:	ethyl 3-(2-iodophenyl)-3-oxopropanoate
Flash_Point:	159.6ºC
FW:	318.10800

MF:	C11H11IO3
Density:	1.622g/cm3
Computational_Chemistry:	['1. XlogP :26 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :3 ', '6. TPSA 434 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :240 ', '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']
More_Info:	['1 . Appearance Liquid ', '2 . Density（g/mL 25ºC）1609 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºCAtmospheric pressure）Unknow ', '5 . Boiling point（ºC，04mmHg）142-144 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index（n20/D）15865 ', '8 . Flash point（ºC，）＞110 ', '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 (mg/mL) Unknow']
Exact_Mass:	317.97500
Flash_Point:	159.6ºC
PSA:	54.37000
Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 6486 ', '2 . Molar volume （m3/mol）1960 ', '3 . Parachor （902K）5121 ', '4 . Surface tension 465 ', '5 . Dielectric constant N/A ', '6 偶极距（10 -24cm 3）N/A ', '7 . Polarizability 2571']
LogP:	2.58470
Bolling_Point:	340.3ºC at 760mmHg
FW:	318.10800
Refractive_Index:	n20/D 1.5865(lit.)