1,2-Benzenedisulfonyldichloride

Product Information

Molecular Formula:
C6H4 Cl2 O4 S2
Molecular Weight:
275.13
Description
1,2-Benzenedisulfonyldichloride is an organic compound used in biomedical research for drug synthesis. Predominantly, it helps make sulfonamide drugs that facilitate research into treatments for various bacterial infections, such as urinary tract and skin infections.
Synonyms
1,2-BENZENEDISULFONYL DICHLORIDE; BENZENE-1,2-DISULFONYL CHLORIDE; BENZENE-1,2-DISULFONYL DICHLORIDE; 1,2-BENZENEDISULFONYL DICHLORIDE 95+%; Benzene-1,2-disulfochloride; o-Benzenedisulfonylchlorid; 1,2-Benzenedisulfonyl chloride; Benzene-1,2-disulfonic acid dic
IUPAC Name
benzene-1,2-disulfonyl chloride
Canonical SMILES
C1=CC=C(C(=C1)S(=O)(=O)Cl)S(=O)(=O)Cl
InChI
InChI=1S/C6H4Cl2O4S2/c7-13(9,10)5-3-1-2-4-6(5)14(8,11)12/h1-4H
InChI Key
YBGQXNZTVFEKEN-UHFFFAOYSA-N
Boiling Point
492.6±18.0 °C(Predicted)
Melting Point
119.0 to 123.0 °C
Purity
>98.0%(T)
Density
0.991±0.06 g/cm3(Predicted)
Appearance
White to Orange to Green powder to crystal

Safety Information

Hazards
H290:
May be corrosive to metals.
H314:
Causes severe skin burns and eye damage.
Precautionary Statement
P260:
Do not breathe dust, fumes, gas, mist, vapours, spray.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P301+P330+P331:
IF SWALLOWED:
Rinse mouth.
Do NOT induce vomiting.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P304+P340+P310:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Immediately call a POISON CENTER or doctor/physician.
P305+P351+P338+P310:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
Immediately call a POISON CENTER or doctor/physician.

Computed Properties

XLogP3
2
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
2
Exact Mass
273.8928063 g/mol
Monoisotopic Mass
273.8928063 g/mol
Topological Polar Surface Area
85Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
349
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

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CN-112546877-A Composite reverse osmosis membrane and preparation method thereof 2021-02-18
CN-112546877-B Composite reverse osmosis membrane and preparation method thereof 2021-02-18
CN-112892233-A Oxidation-resistant polyester composite film and preparation method thereof 2021-02-04
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The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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