4-CARBOXY-3-CHLOROPHENYLBORONIC ACID

Catalog No: FT-0643254

CAS No: 136496-72-5

Chemical Name: 4-CARBOXY-3-CHLOROPHENYLBORONIC ACID
Molecular Formula: C7H6BClO4
Molecular Weight: 200.38
InChI Key: QFAFGWXQNDYXPZ-UHFFFAOYSA-N
InChI: InChI=1S/C7H6BClO4/c9-6-3-4(8(12)13)1-2-5(6)7(10)11/h1-3,12-13H,(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

Product_Name:	2-Chloro-4-(dihydroxyboryl)benzoic acid
Flash_Point:	213.3±31.5 °C
Melting_Point:	236-238
FW:	200.384
Density:	1.6±0.1 g/cm3
CAS:	136496-72-5
Bolling_Point:	429.2±55.0 °C at 760 mmHg
MF:	C7H6BClO4

Molecular_Structure:	['1. Molar refractive index 4439 ', '2. Molar volume 1291 ', '3. Parachor （902K）3693 ', '4. Surface tension 669 ', '5. Dielectric constant N/A ', '6. Polarizability 1759 ', '7. Single isotope mass 200004767 Da ', '8. Nominal mass 200 Da ', '9. Average mass 2003841 Da']
Flash_Point:	213.3±31.5 °C
Refractive_Index:	1.604
FW:	200.384
Density:	1.6±0.1 g/cm3
Bolling_Point:	429.2±55.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :3 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 778 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :199 ', '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:	1.41
Melting_Point:	236-238
PSA:	77.76000
MF:	C7H6BClO4
More_Info:	['1 . Appearance White 晶体状粉末 ', '2 . Density（g/mL,20℃）088 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）232 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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 Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow']
Vapor_Pressure:	0.0±1.1 mmHg at 25°C
Exact_Mass:	200.004761