2-Bromo-6-methylbenzoic acid

Catalog No: FT-0650505

CAS No: 90259-31-7

Chemical Name: 2-Bromo-6-methylbenzoic acid
Molecular Formula: C8H7BrO2
Molecular Weight: 215.04
InChI Key: ICXBPDJQFPIBSS-UHFFFAOYSA-N
InChI: InChI=1S/C8H7BrO2/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4H,1H3,(H,10,11)

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

Symbol:	Danger
FW:	215.044
Density:	1.6±0.1 g/cm3
CAS:	90259-31-7
Bolling_Point:	310.1±30.0 °C at 760 mmHg
Product_Name:	4-Bromo-2-methylbenzoic acid
Melting_Point:	108-112 °C
Flash_Point:	141.3±24.6 °C
MF:	C8H7BrO2

Molecular_Structure:	['1 . Molar refractive index 4569 ', '2 . Molar volume （m3/mol）1344 ', '3 . Parachor (902K)3575 ', '4 表面张力(dyne/cm)500 ', '5 . Polarizability (10-24cm3)1811']
Flash_Point:	141.3±24.6 °C
Refractive_Index:	1.595
FW:	215.044
Density:	1.6±0.1 g/cm3
Bolling_Point:	310.1±30.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 373 ', '7. Heavy Atom Count :11 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :158 ', '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']
LogP:	3.32
Melting_Point:	108-112 °C
PSA:	37.30000
MF:	C8H7BrO2
More_Info:	['1 . Appearance Solid ', '2 . Density（g/mL25 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）108-112 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC008mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC008mmHg）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,）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（正Octanol /Water ）Logarithmic Value of Distribution Coefficient 2，429 ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility 不能溶解于Water ']
Vapor_Pressure:	0.0±0.7 mmHg at 25°C
Exact_Mass:	213.962936

Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Faceshields;Gloves
Hazard_Codes:	Xn:Harmful;
Risk_Statements(EU):	R22
Safety_Statements:	S26-S36/37/39
Symbol:	Danger
Warning_Statement:	P301 + P310-P305 + P351 + P338
RIDADR:	UN 2811 6.1/PG 3
HS_Code:	2916399090
WGK_Germany:	3