Name: (3aS,4R,5R,7aS)-7-bromo-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol
Brand: FINETECH INDUSTRY LIMITED
SKU: FT-0772876

Catalog No: FT-0772876

CAS No: 130669-72-6

Chemical Name: (3aS,4R,5R,7aS)-7-bromo-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol
Molecular Formula: C9H13BrO4
Molecular Weight: 265.10
InChI Key: UGCLVZMHFRQWFL-XUTVFYLZSA-N
InChI: InChI=1S/C9H13BrO4/c1-9(2)13-7-4(10)3-5(11)6(12)8(7)14-9/h3,5-8,11-12H,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:	375.69ºC at 760 mmHg
CAS:	130669-72-6
MF:	C9H13BrO4
Density:	1.649g/cm3
Melting_Point:	121-124ºC(lit.)
Product_Name:	(3aS,4R,5R,7aS)-7-bromo-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol
Flash_Point:	181.011ºC
FW:	265.10100

MF:	C9H13BrO4
Density:	1.649g/cm3
Computational_Chemistry:	['1. XlogP :-01 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 589 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :276 ', '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:	264.00000
Vapor_Pressure:	0mmHg at 25°C
Flash_Point:	181.011ºC
PSA:	58.92000
Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 5343 ', '2 . Molar volume 1608 ', '3 . Parachor （902K）4309 ', '4 . Surface tension 515 ', '5 . Polarizability 2118']
LogP:	0.52070
Melting_Point:	121-124ºC(lit.)
Bolling_Point:	375.69ºC at 760 mmHg
FW:	265.10100
Refractive_Index:	1.579