(3aS,5aR,6aR,6bS)-4-bromo-2,2-dimethyl-3a,5a,6a,6b-tetrahydrooxireno[2,3-g][1,3]benzodioxole

Catalog No: FT-0774271

CAS No: 130669-74-8

Chemical Name: (3aS,5aR,6aR,6bS)-4-bromo-2,2-dimethyl-3a,5a,6a,6b-tetrahydrooxireno[2,3-g][1,3]benzodioxole
Molecular Formula: C9H11BrO3
Molecular Weight: 247.09
InChI Key: IJFOOAYHPAECGI-WCTZXXKLSA-N
InChI: InChI=1S/C9H11BrO3/c1-9(2)12-6-4(10)3-5-7(11-5)8(6)13-9/h3,5-8H,1-2H3/t5-,6-,7-,8-/m1/s1

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:	293.785ºC at 760 mmHg
CAS:	130669-74-8
MF:	C9H11BrO3
Density:	1.577g/cm3
Melting_Point:	76-79ºC(lit.)
Product_Name:	(3aS,5aR,6aR,6bS)-4-bromo-2,2-dimethyl-3a,5a,6a,6b-tetrahydrooxireno[2,3-g][1,3]benzodioxole
Flash_Point:	117.688ºC
FW:	247.08600

MF:	C9H11BrO3
Density:	1.577g/cm3
Computational_Chemistry:	['1. XlogP :09 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 31 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :287 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :4 ', '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:	245.98900
Vapor_Pressure:	0.003mmHg at 25°C
Flash_Point:	117.688ºC
PSA:	30.99000
Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 4990 ', '2 . Molar volume 1566 ', '3 . Parachor （902K）3878 ', '4 . Surface tension 375 ', '5 . Polarizability 1978']
LogP:	1.56630
Melting_Point:	76-79ºC(lit.)
Bolling_Point:	293.785ºC at 760 mmHg
FW:	247.08600
Refractive_Index:	1.55