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CAS No.: | 51419-59-1 |
---|---|
Name: | 4-Methylbenzylsulfonyl chloride |
Article Data: | 26 |
Molecular Structure: | |
Formula: | C8H9ClO2S |
Molecular Weight: | 204.677 |
Synonyms: | (4-Methylphenyl)methanesulfonylchloride;p-Methylbenzylsulfonyl chloride;p-Tolylmethanesulfonyl chloride;p-Tolylmethylsulfonyl chloride; |
Density: | 1.325 g/cm3 |
Melting Point: | 80-85 °C |
Boiling Point: | 305.2 °C at 760 mmHg |
Flash Point: | 138.4 °C |
Hazard Symbols: | C,Xi |
Risk Codes: | 22-34 |
Safety: | 26-28-36/37/39-45 |
PSA: | 42.52000 |
LogP: | 3.14440 |
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The Benzenemethanesulfonylchloride, 4-methyl-, with the CAS registry number 51419-59-1, is also known as 4-Methylbenzenemethanesulfonyl chloride. It belongs to the product categories of Fluorobenzene; Phenyls & Phenyl-Het; Sulphonyl Chlorides; Phenyls & Phenyl-Het; Sulphonyl Chlorides. This chemical's molecular formula is C8H9ClO2S and molecular weight is 204.67. Its IUPAC name is called (4-methylphenyl)methanesulfonyl chloride. The product should be sealed and stored in cool and dry place.
Physical properties of Benzenemethanesulfonylchloride, 4-methyl-: (1)ACD/LogP: 2.47; (2)ACD/LogD (pH 5.5): 2.47; (3)ACD/LogD (pH 7.4): 2.47; (4)ACD/BCF (pH 5.5): 44.51; (5)ACD/BCF (pH 7.4): 44.51; (6)ACD/KOC (pH 5.5): 526.69; (7)ACD/KOC (pH 7.4): 526.69; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.556; (11)Molar Refractivity: 49.65 cm3; (12)Molar Volume: 154.4 cm3; (13)Surface Tension: 46.5 dyne/cm; (14)Density: 1.325 g/cm3; (15)Flash Point: 138.4 °C; (16)Enthalpy of Vaporization: 52.38 kJ/mol; (17)Boiling Point: 305.2 °C at 760 mmHg; (18)Vapour Pressure: 0.0015 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes and may destroy living tissue on contact. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=C(C=C1)CS(=O)(=O)Cl
(2)InChI: InChI=1S/C8H9ClO2S/c1-7-2-4-8(5-3-7)6-12(9,10)11/h2-5H,6H2,1H3
(3)InChIKey: JALKUHLLMWYIAT-UHFFFAOYSA-N