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58722-36-4

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Basic Information
CAS No.: 58722-36-4
Name: 4-(BROMOACETYL)-N,N-DIETHYLBENZENESULFONAMIDE
Molecular Structure:
Molecular Structure of 58722-36-4 (4-(BROMOACETYL)-N,N-DIETHYLBENZENESULFONAMIDE)
Formula: C12H16BrNO3S
Molecular Weight: 334.234
Synonyms: Benzenesulfonamide,4-(bromoacetyl)-N,N-diethyl- (9CI);
Density: 1.436 g/cm3
Boiling Point: 428.9 °C at 760 mmHg
Flash Point: 213.2 °C
PSA: 62.83000
LogP: 3.37550
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    58722-36-4

    Benzenesulfonamide,4-(2-bromoacetyl)-N,N-diethyl-

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  • 4-(BROMOACETYL)-N,N-DIETHYLBENZENESULFONAMIDE

  • Casno:

    58722-36-4

    4-(BROMOACETYL)-N,N-DIETHYLBENZENESULFONAMIDE

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    4-(BROMOACETYL)-N,N-DIETHYLBENZENESULFONAMIDEAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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  • 58722-36-4

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    58722-36-4

    58722-36-4

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Specification

The CAS registry number of Benzenesulfonamide,4-(2-bromoacetyl)-N,N-diethyl- is 58722-36-4. This chemical is also named as Benzenesulfonamide,4-(bromoacetyl)-N,N-diethyl- (9CI). In addition, its molecular formula is C12H16BrNO3S and molecular weight is 334.2293. Its IUPAC name is called 4-(2-bromoacetyl)-N,N-diethylbenzenesulfonamide.

Physical properties about Benzenesulfonamide,4-(2-bromoacetyl)-N,N-diethyl- are: (1)ACD/LogP: 2.84; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Index of Refraction: 1.558; (7)Molar Refractivity: 75.07 cm3; (8)Molar Volume: 232.6 cm3; (9)Surface Tension: 46 dyne/cm; (10)Density: 1.436 g/cm3; (11)Flash Point: 213.2 °C; (12)Enthalpy of Vaporization: 68.42 kJ/mol; (13)Boiling Point: 428.9 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(N(CC)CC)c1ccc(C(=O)CBr)cc1
(2)InChI: InChI=1/C12H16BrNO3S/c1-3-14(4-2)18(16,17)11-7-5-10(6-8-11)12(15)9-13/h5-8H,3-4,9H2,1-2H3
(3)InChIKey: XSACATWDWOSQKU-UHFFFAOYAE