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| CAS No.: | 10147-37-2 |
|---|---|
| Name: | ISOPROPYLSULFONYL CHLORIDE |
| Article Data: | 22 |
| Molecular Structure: | |
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|
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| Formula: | C3H7ClO2S |
| Molecular Weight: | 142.606 |
| Synonyms: | 1-Methylethylsulfonylchloride;2-Propylsulfonyl chloride;Isopropanesulfonyl chloride;Isopropyl-2-sulphonyl chloride;Isopropylsulfonyl chloride;i-Propanesulfonylchloride; |
| EINECS: | 233-415-2 |
| Density: | 1.27 g/mL at 25 °C(lit.) |
| Melting Point: | -47°C |
| Boiling Point: | 74-75 °C19 mm Hg(lit.)，181.4 °C at 760 mmHg |
| Flash Point: | 59.5 °C |
| Solubility: | Reacts with water. |
| Appearance: | clear pale yellow-greenish liquid |
| Hazard Symbols: |
 C
|
| Risk Codes: | 34 |
| Safety: | 26-28-36/37/39-45 |
| Transport Information: | UN 3265 8 |
| PSA: | 42.52000 |
| LogP: | 2.04420 |
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Specification
The Isopropylsulfonyl chloride with cas registry number of 10147-37-2 is clear pale yellow-greenish liquid which is sensitive to lachrymatory. It also has the EINECS registry number which is 233-415-2. Both its systematic name and IUPAC name are the same which is called propane-2-sulfonyl chloride. It belongs to several classes: Organic Building Blocks; Sulfonyl Halides; Sulfur Compounds.
The physical properties about this chemical are: (1)ACD/LogP: 1.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.11; (4)ACD/LogD (pH 7.4): 1.11; (5)ACD/BCF (pH 5.5): 4.13; (6)ACD/BCF (pH 7.4): 4.13; (7)ACD/KOC (pH 5.5): 96.13; (8)ACD/KOC (pH 7.4): 96.13; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.445; (13)Molar Refractivity: 29.55 cm3; (14)Molar Volume: 110.8 cm3; (15)Surface Tension: 35.4 dyne/cm; (16)Density: 1.286 g/cm3; (17)Flash Point: 59.5 °C; (18)Enthalpy of Vaporization: 40.05 kJ/mol; (19)Boiling Point: 181.4 °C at 760 mmHg; (20)Vapour Pressure: 1.16 mmHg at 25°C ; (21)Refractive Index: n20/D 1.453(lit.).
Preparation of Isopropylsulfonyl chloride: it can be prepared by propane-2-thiol with reagent Cl2 and solvent Acetic acid.
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Uses of Isopropylsulfonyl chloride: this chemical can be made by propane-2-sulfonamide with reagents NH3 and solvent toluene at temperature of -78 ℃.
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When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. Therefore, wear suitable protective clothing, gloves and eye/face protection during using it. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: ClS(=O)(=O)C(C)C;
(2)InChI: InChI=1/C3H7ClO2S/c1-3(2)7(4,5)6/h3H,1-2H3;
(3)InChIKey: DRINJBFRTLBHNF-UHFFFAOYAS