(R)-(-)-2-(P-toluenesulfonate)-1, 2-propanol supplier

Name
(R)-(-)-2-(P-TOLUENESULFONATE)-1,2-PROPANOL
EINECS
CAS No. 69891-44-7
Article Data1
CAS DataBase
Density 1.246 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₄O₄S
Boiling Point 379.5 °C at 760 mmHg
Molecular Weight 230.285
Flash Point 183.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Toluenesulfonate propaniol;
PSA 71.98000
LogP 2.16190

(R)-(-)-2-(P-toluenesulfonate)-1, 2-propanol Specification

The (R)-(-)-2-(P-toluenesulfonate)-1, 2-propanol, with the CAS registry number of 69891-44-7, is also known as Toluenesulfonate propaniol. This chemical's molecular formula is C₁₀H₁₄O₄S and molecular weight is 230.28. What's more, its systematic name is [(1R)-2-Hydroxy-1-methyl-ethyl] 4-methylbenzenesulfonate.

Physical properties about (R)-(-)-2-(P-toluenesulfonate)-1, 2-propanol are: (1)ACD/LogP: 1.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.02; (4)ACD/LogD (pH 7.4): 1.02; (5)#H bond acceptors: 4; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 5; (8)Polar Surface Area: 71.98 Å²; (9)Index of Refraction: 1.532; (10)Molar Refractivity: 57.33 cm³; (11)Molar Volume: 184.7 cm³; (12)Polarizability: 22.72×10^-24 cm³; (13)Surface Tension: 44.4 dyne/cm; (14)Density: 1.246 g/cm³; (15)Flash Point: 183.3 °C; (16)Enthalpy of Vaporization: 66.2 kJ/mol; (17)Boiling Point: 379.5 °C at 760 mmHg; (18)Vapour Pressure: 1.95E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=S(=O)(O[C@H](C)CO)c1ccc(C)cc1
(2) InChI: InChI=1/C10H14O4S/c1-8-3-5-10(6-4-8)15(12,13)14-9(2)7-11/h3-6,9,11H,7H2,1-2H3/t9-/m1/s1
(3) InChIKey: UADUJNAWMVEFHR-SECBINFHBN

Product Name

(R)-(-)-2-(P-TOLUENESULFONATE)-1,2-PROPANOL

(R)-(-)-2-(P-toluenesulfonate)-1, 2-propanol Specification

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