4-(Aminosulfonyl)phenylboronic acid supplier

Name
4-(Aminosulfonyl)phenylboronic acid
EINECS
CAS No. 613660-87-0
Article Data2
CAS DataBase
Density 1.54 g/cm³
Solubility
Melting Point 250-256
Formula C₆H₈BNO₄S
Boiling Point 461.944 °C at 760 mmHg
Molecular Weight 201.011
Flash Point 233.176 °C
Transport Information
Appearance
Safety 26-36/37
Risk Codes 36-20/21/22
Molecular Structure
Hazard Symbols Xi,Xn
Synonyms (4-Sulfamoylphenyl)boronic acid;4-Aminosulfonylphenylboronic acid;Boronicacid, [4-(aminosulfonyl)phenyl]- (9CI);
PSA 109.00000
LogP -0.20510

4-(Aminosulfonyl)phenylboronic acid Specification

The 4-(Aminosulfonyl)phenylboronic acid, with the CAS registry number 613660-87-0, is also known as Boronic acid, B-[4-(aminosulfonyl)phenyl]-. It belongs to the product categories of Blocks; BoronicAcids; Sulfonamides;API Intermediates. This chemical's molecular formula is C₆H₈BNO₄S and molecular weight is 201.01. What's more, both its IUPAC name and systematic name are the same which is called (4-Sulfamoylphenyl)boronic acid. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 4-(Aminosulfonyl)phenylboronic acid are: (1)ACD/LogP: -0.45; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 16; (6)ACD/KOC (pH 7.4): 13; (7)#H bond acceptors: 5; (8)#H bond donors: 4; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 109 Å²; (11)Index of Refraction: 1.618; (12)Molar Refractivity: 45.727 cm³; (13)Molar Volume: 130.54 cm³; (14)Surface Tension: 71.311 dyne/cm; (15)Density: 1.54 g/cm³; (16)Flash Point: 233.176 °C; (17)Enthalpy of Vaporization: 76.168 kJ/mol; (18)Boiling Point: 461.944 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OB(O)c1ccc(cc1)S(N)(=O)=O
(2) InChI: InChI=1S/C6H8BNO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h1-4,9-10H,(H2,8,11,12)
(3) InChIKey: AKSXQPCIAOIJGP-UHFFFAOYSA-N

Product Name

4-(Aminosulfonyl)phenylboronic acid

4-(Aminosulfonyl)phenylboronic acid Specification

Related Products

Hot Products