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CAS No.: | 486422-59-7 |
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Name: | 4-(N,N-DIMETHYLSULPHONAMIDO)BENZENEBORONIC ACID |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C8H12 B N O4 S |
Molecular Weight: | 229.065 |
Synonyms: | Boronicacid, [4-[(dimethylamino)sulfonyl]phenyl]- (9CI);4-[(Dimethylamino)sulfonyl]benzeneboronic acid;[4-(N,N-Dimethylaminosulfonyl)phenyl]boronic acid;[4-(N,N-Dimethylsulfamoyl)phenyl]boronic acid;[4-[(Dimethylamino)sulfonyl]phenyl]boronic acid |
Density: | 1.37g/cm3 |
Melting Point: | 140-144 |
Boiling Point: | 410°Cat760mmHg |
Flash Point: | 201.7°C |
Hazard Symbols: | Xi |
PSA: | 86.22000 |
LogP: | -0.30250 |
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Systematic Name: [4-(Dimethylsulfamoyl)phenyl]boronic acid
SMILES: B(c1ccc(cc1)S(=O)(=O)N(C)C)(O)O
InChI: InChI=1/C8H12BNO4S/c1-10(2)15(13,14)8-5-3-7(4-6-8)9(11)12/h3-6,11-12H,1-2H3
InChIKey: VVUGXBSXXJTVDS-UHFFFAOYAJ
Empirical Formula: C8H12BNO4S
Molecular Weight: 229.0612
Nominal Mass: 229
Average Mass: 229.0612
Monoisotopic Mass: 229.058009
Product Categories: blocks; BoronicAcids; Sulfonamides
Melting Point: 140-144 °C
H bond acceptors: 5 H bond donors: 2
Freely Rotating Bonds: 5
Index of Refraction: 1.579
Molar Refractivity: 55.24 cm3
Molar Volume: 166.1 cm3
Surface Tension: 56.8 dyne/cm
Density: 1.37 g/cm3
Flash Point: 201.7 °C
Enthalpy of Vaporization: 69.82 kJ/mol
Boiling Point: 410 °C at 760 mmHg
Vapour Pressure: 1.86E-07 mmHg at 25 °C
storage temp. of 4-(N,N-Dimethylsulphonamido)benzeneboronic acid (CAS NO.486422-59-7): Keep Cold
Hazard Codes: Xi
Hazard Note of 4-(N,N-Dimethylsulphonamido)benzeneboronic acid (CAS NO.486422-59-7): Irritant/Keep Cold
4-(N,N-Dimethylsulphonamido)benzeneboronic acid (CAS NO.486422-59-7), its Synonyms are [4-(Dimethylsulfamoyl)phenyl]boronic acid ; Boronic acid, B-[4-[(dimethylamino)sulfonyl]phenyl]- ; 4-(N,N-Dimethylsulfamoyl)phenylboronic acid ; 4-(N,N-Dimethylsulphonamido)benzeneboronic acid 95% ; 4-Borono-N,N-dimethylbenzenesulphonamide .