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2-Thiophenesulfonylchloride, 5-(phenylsulfonyl)-

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Name

2-Thiophenesulfonylchloride, 5-(phenylsulfonyl)-

EINECS -0
CAS No. 166964-37-0 Density 1.582 g/cm3
PSA 113.28000 LogP 4.67000
Solubility N/A Melting Point 103 °C
Formula C10H7ClO4S3 Boiling Point 519.7 °C at 760 mmHg
Molecular Weight 322.814 Flash Point 268.1 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39-45 Risk Codes 34
Molecular Structure Molecular Structure of 166964-37-0 (5-(PHENYLSULFONYL)THIOPHENE-2-SULFONYL CHLORIDE) Hazard Symbols CorrosiveC
Synonyms

5-(Benzenesulfonyl)thiophene-2-sulfonylchloride;5-(Phenylsulfonyl)thiophene-2-sulfonyl chloride;

 

2-Thiophenesulfonylchloride, 5-(phenylsulfonyl)- Specification

The 2-Thiophenesulfonylchloride, 5-(phenylsulfonyl)- is an organic compound with the formula C10H7ClO4S3. The systematic name of this chemical is 5-(Phenylsulfonyl)thiophene-2-sulfonyl chloride. With the CAS registry number 166964-37-0, it is also named as 5-Phenylthiophene-2,5-disulphonyl chloride. The product's categories is Benzenesulfonyl chloride. Besides, it should be stored under Nitrogen and in a cool, sealed, well-ventilated place.

Physical properties about 2-Thiophenesulfonylchloride, 5-(phenylsulfonyl)- are: (1)ACD/LogP: 2.86; (2)ACD/LogD (pH 5.5): 2.86; (3)ACD/LogD (pH 7.4): 2.86; (4)ACD/BCF (pH 5.5): 88.28; (5)ACD/BCF (pH 7.4): 88.28; (6)ACD/KOC (pH 5.5): 859.91; (7)ACD/KOC (pH 7.4): 859.91; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 113.28 Å2; (11)Index of Refraction: 1.624; (12)Molar Refractivity: 72.06 cm3; (13)Molar Volume: 203.9 cm3; (14)Polarizability: 28.57×10-24 cm3; (15)Surface Tension: 56.3 dyne/cm; (16)Density: 1.582 g/cm3; (17)Flash Point: 268.1 °C; (18)Enthalpy of Vaporization: 76.27 kJ/mol; (19)Boiling Point: 519.7 °C at 760 mmHg; (20)Vapour Pressure: 2.19E-10 mmHg at 25 °C.

Uses of 2-Thiophenesulfonylchloride, 5-(phenylsulfonyl)-: it can be used to produce 5-Benzenesulfonyl-thiophene-2-sulfonic acid amide at temperature of -78 °C. It will need reagent NH3 and solvent CH2Cl2 with reaction time of 4 hours. The yield is about 96%.

When you are using this chemical, please be cautious about it as the following:
It causes burns. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H7ClO4S3/c11-18(14,15)10-7-6-9(16-10)17(12,13)8-4-2-1-3-5-8/h1-7H
(2)InChIKey: GSLVRDAYMHUGTF-UHFFFAOYAS
(3)Std. InChI: InChI=1S/C10H7ClO4S3/c11-18(14,15)10-7-6-9(16-10)17(12,13)8-4-2-1-3-5-8/h1-7H
(4)Std. InChIKey: GSLVRDAYMHUGTF-UHFFFAOYSA-N

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