Basic Information | Post buying leads | Suppliers |
Name |
Boronic acid,B-[4-(4-thiomorpholinylsulfonyl)phenyl]- |
EINECS | N/A |
CAS No. | 871329-69-0 | Density | 1.48 g/cm3 |
PSA | 111.52000 | LogP | 0.12260 |
Solubility | N/A | Melting Point |
276-280 °C |
Formula | C10H14BNO4S2 | Boiling Point | 521.3 °C at 760 mmHg |
Molecular Weight | 287.168 | Flash Point | 269.1 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Boronicacid, [4-(4-thiomorpholinylsulfonyl)phenyl]- (9CI);[4-(Thiomorpholine-4-sulfonyl)phenyl]boronic acid;[4-[(4-Thiomorpholinyl)sulfonyl]phenyl]boronic acid; |
The Boronic acid,B-[4-(4-thiomorpholinylsulfonyl)phenyl]- is an organic compound with the formula C10H14BNO4S2. The systematic name of this chemical is (4-thiomorpholinosulfonylphenyl)boronic acid. With the CAS registry number 871329-69-0, it is also named as N-Thiomorpholin-4-yl 4-boronobenzenesulphonamide. The product's categories are Blocks; BoronicAcids; Sulfonamides.
Physical properties about Boronic acid,B-[4-(4-thiomorpholinylsulfonyl)phenyl]- are: (1)ACD/LogP: 1.28; (2)ACD/LogD (pH 5.5): 1.28; (3)ACD/LogD (pH 7.4): 1.19; (4)#H bond acceptors: 5; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 5; (7)Polar Surface Area: 111.52 Å2; (8)Index of Refraction: 1.647; (9)Molar Refractivity: 70.48 cm3; (10)Molar Volume: 193.9 cm3; (11)Polarizability: 27.94×10-24cm3; (12)Surface Tension: 69.1 dyne/cm; (13)Density: 1.48 g/cm3; (14)Flash Point: 269.1 °C; (15)Enthalpy of Vaporization: 83.64 kJ/mol; (16)Boiling Point: 521.3 °C at 760 mmHg; (17)Vapour Pressure: 1.07E-11 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: B(c1ccc(cc1)S(=O)(=O)N2CCSCC2)(O)O
(2)InChI: InChI=1/C10H14BNO4S2/c13-11(14)9-1-3-10(4-2-9)18(15,16)12-5-7-17-8-6-12/h1-4,13-14H,5-8H2
(3)InChIKey: ROGGFXZKSGGVQE-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C10H14BNO4S2/c13-11(14)9-1-3-10(4-2-9)18(15,16)12-5-7-17-8-6-12/h1-4,13-14H,5-8H2
(5)Std. InChIKey: ROGGFXZKSGGVQE-UHFFFAOYSA-N