4,7-DIHYDRO-2-PHENYL-1,3-DIOXEPIN

Catalog No: FT-0634372

CAS No: 2568-24-3

Chemical Name: 4,7-DIHYDRO-2-PHENYL-1,3-DIOXEPIN
Molecular Formula: C11H12O2
Molecular Weight: 176.21
InChI Key: DRRPAFPCDLXMFG-UHFFFAOYSA-N
InChI: InChI=1S/C11H12O2/c1-2-6-10(7-3-1)11-12-8-4-5-9-13-11/h1-7,11H,8-9H2

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

Base Information
Chemical Information

Melting_Point:	N/A
CAS:	2568-24-3
MF:	C11H12O2
Flash_Point:	113ºC
Product_Name:	2-phenyl-4,7-dihydro-1,3-dioxepine
Density:	1.11 g/mL at 25ºC(lit.)
FW:	176.21200
Bolling_Point:	114ºC/3.5 mmHg(lit.)

Refractive_Index:	n20/D 1.543(lit.)
Vapor_Pressure:	0.00772mmHg at 25°C
Flash_Point:	113ºC
LogP:	2.28820
Bolling_Point:	114ºC/3.5 mmHg(lit.)
FW:	176.21200
PSA:	18.46000
Computational_Chemistry:	['1. XlogP :18 ', '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 185 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :161 ', '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']
MF:	C11H12O2
Exact_Mass:	176.08400
Molecular_Structure:	['1 . Molar refractive index 5031 ', '2 . Molar volume （m3/mol）1637 ', '3 . Parachor （902K）4141 ', '4 . Surface tension 409 ', '5 . Dielectric constant （F/m）无可用 ', '6 偶极距（D）无可用 ', '7 . Polarizability （10 -24cm 3）1994']
Density:	1.11 g/mL at 25ºC(lit.)
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mLat 25°C）111 ', '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,35mmHg）114 ', '7 . Refractive index（n20/D）1543 ', '8 . Flash point（ºC）113 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,211ºC）Unknow ', '12 . Saturated vapor pressure（kPa,1144 ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（MPa）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']