2-(CARBOXYMETHYLTHIO)BENZOIC ACID

Catalog No: FT-0610835

CAS No: 135-13-7

Molecular Formula: 212.22
Formula Weight: C9H8O4S
Inchl Key: GMBZSYUPMWCDGK-UHFFFAOYSA-N
Inchl: InChI=1S/C9H8O4S/c10-8(11)5-14-7-4-2-1-3-6(7)9(12)13/h1-4H,5H2,(H,10,11)(H,12,13)

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

FW:	212.22200
CAS:	135-13-7
Melting_Point:	208 °C
Bolling_Point:	423ºC at 760 mmHg
MF:	C9H8O4S
Product_Name:	2-(carboxymethylsulfanyl)benzoic acid
Flash_Point:	209.6ºC
Density:	1.49 g/cm3

FW:	212.22200
MF:	C9H8O4S
Flash_Point:	209.6ºC
LogP:	1.56150
Bolling_Point:	423ºC at 760 mmHg
Exact_Mass:	212.01400
PSA:	99.90000
Computational_Chemistry:	['1. XlogP :16 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 999 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :229 ', '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']
Vapor_Pressure:	6.55E-08mmHg at 25°C
Density:	1.49 g/cm3
Melting_Point:	208 °C
Molecular_Structure:	['分子性质数据 ', '1 . Molar refractive index 5195 ', '2 . Molar volume （m3/mol）1424 ', '3 . Parachor （902K）4187 ', '4 表面张力（30 dyne/cm）747 ', '5 . Polarizability （05 10 -24cm 3）2059']