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247089-85-6

Basic Information
CAS No.: 247089-85-6
Name: (R)-(-)-4-Methylbezenesulfinamide
Article Data: 9
Molecular Structure:
Molecular Structure of 247089-85-6 ((R)-(-)-4-Methylbezenesulfinamide)
Formula: C7H9NOS
Molecular Weight: 155.221
Synonyms: (-)-(R)-p-Toluenesulfinamide;(R)-(-)-p-Toluenesulfinamide;(R)-Tolylsulfinamide;(R)-p-Toluenesulfinamide;
Density: 1.29 g/cm3
Melting Point: 115-118 °C(lit.)
Boiling Point: 322.362 °C at 760 mmHg
Flash Point: 148.76 °C
Appearance: white to light yellow crystal powder
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 62.30000
LogP: 2.54230
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Specification

The CAS registry number of (R)-(-)-4-Methylbezenesulfinamide is 247089-85-6. In addition, the molecular formula is C7H9NOS and the molecular weight is 155.22. The systematic name is 4-methylbenzenesulfinamide. What's more, it is a kind of white to light yellow crystal powder and belongs to the classes of Chiral Building Blocks; Organic Building Blocks; Sulfonamides/Sulfinamides. Besides, it should be stored in sealed container, and put in a cool and dry place.

Physical properties about (R)-(-)-4-Methylbezenesulfinamide are: (1)ACD/LogP: 0.62; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 38; (5)ACD/KOC (pH 7.4): 37; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 62.3 Å2; (10)Index of Refraction: 1.65; (11)Molar Refractivity: 43.869 cm3; (12)Molar Volume: 120.336 cm3; (13)Polarizability: 17.391 ×10-24cm3; (14)Surface Tension: 67.259 dyne/cm; (15)Density: 1.29 g/cm3; (16)Flash Point: 148.76 °C; (17)Enthalpy of Vaporization: 56.42 kJ/mol; (18)Boiling Point: 322.362 °C at 760 mmHg.

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. It is irritating to eyes, respiratory system and skin. Whenever you will contact it, please wear suitable protective clothing. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(c1ccc(cc1)C)N
(2)InChI: InChI=1/C7H9NOS/c1-6-2-4-7(5-3-6)10(8)9/h2-5H,8H2,1H3/t10-/m1/s1
(3)InChIKey: YNJDSRPIGAUCEE-SNVBAGLBBS