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3079-82-1

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Basic Information
CAS No.: 3079-82-1
Name: 1,4-BUTANEDISULFONYLCHLORIDE
Molecular Structure:
Molecular Structure of 3079-82-1 (1,4-BUTANEDISULFONYLCHLORIDE)
Formula: C4H8Cl2O4S2
Molecular Weight: 255.143
Synonyms: 1,4-Butanedisulfonylchloride (6CI,7CI,8CI);NSC 240396;Butane-1,4-disulfonyl chloride;
Density: 1.6 g/cm3
Boiling Point: 361.9 °C at 760 mmHg
Flash Point: 172.7 °C
PSA: 85.04000
LogP: 3.06540
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Specification

The 1,4-Butanedisulfonyldichloride is an organic compound with the formula C4H8Cl2O4S2. The IUPAC name of this chemical is Butane-1,4-disulfonyl chloride. The CAS registry number of this chemical is 3079-82-1. Besides, its molecular weight is 255.14.

The physical properties of 1,4-Butanedisulfonyldichloride are: (1)ACD/LogP: 1.08; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 85.04 Å2; (5)Index of Refraction: 1.512; (6)Molar Refractivity: 47.86 cm3; (7)Molar Volume: 159.3 cm3; (8)Polarizability: 18.97×10-24 cm3; (9)Surface Tension: 55.2 dyne/cm; (10)Density: 1.6 g/cm3; (11)Flash Point: 172.7 °C; (12)Enthalpy of Vaporization: 58.39 kJ/mol; (13)Boiling Point: 361.9 °C at 760 mmHg; (14)Vapour Pressure: 4.18E-05 mmHg at 25 °C.

Preparation: this chemical can be prepared by Butane-1,4-dithiol. This reaction will need reagent Cl2, solvents H2O and acetic acid. The reaction time is 15 min with reaction temperature of 30 °C. The yield is about 67%.

1,4-Butanedisulfonyldichloride can be obtained by Butane-1,4-dithiol

Uses of 1,4-Butanedisulfonyldichloride: it can be used to produce Butane-1,4-disulfonamide at temperature of 25 °C. It will need reagent NH3 and solvent CH2Cl2. The yield is about 75.8%.

1,4-Butanedisulfonyldichloride can be used to produce Butane-1,4-disulfonamide

You can still convert the following datas into molecular structure:
(1)SMILES: ClS(=O)(=O)CCCCS(Cl)(=O)=O
(2)InChI: InChI=1/C4H8Cl2O4S2/c5-11(7,8)3-1-2-4-12(6,9)10/h1-4H2
(3)InChIKey: VZHRPLJULARYDO-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C4H8Cl2O4S2/c5-11(7,8)3-1-2-4-12(6,9)10/h1-4H2
(5)Std. InChIKey: VZHRPLJULARYDO-UHFFFAOYSA-N