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Home > Encyclopedia > 2-Thiopheneethanol, 2-(4-methylbenzenesulfonate)

2-Thiopheneethanol, 2-(4-methylbenzenesulfonate)

2-Thiopheneethanol, 2-(4-methylbenzenesulfonate) structure

2-Thiopheneethanol, 2-(4-methylbenzenesulfonate) 

structure
  • CAS No:

    40412-06-4

  • Formula:

    C13H14O3S2

  • Chemical Name:

    2-Thiopheneethanol, 2-(4-methylbenzenesulfonate)

  • Synonyms:

    2-Thiopheneethanol,2-(4-methylbenzenesulfonate);2-Thiopheneethanol,4-methylbenzenesulfonate;2-(2-Thienyl)ethyl toluene-p-sulfonate;2-Thiopheneethanol p-toluenesulfonate;2-(2-Thienyl)ethyl tosylate;2-(2-Thiophene)ethanol tosylate;2-Thiopheneethanol tosylate;2-(Thien-2-yl)ethyl 4-methylbenzenesulfonate;2-Thienylethyl p-toluenesulfonate;2-Thiophen-2-ylethyl 4-methylbenzenesulfonate

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

Off-White Solid

2-Thiopheneethanol, 2-(4-methylbenzenesulfonate) Basic Attributes

282.379

282.38

254-911-5

DKB7RKL3U8

DTXSID80193429

2934999090

Characteristics

79.99000

3.2

Off-white solid

1.3±0.1 g/cm3

30.0 to 34.0 °C

433.2±33.0 °C at 760 mmHg

215.8±25.4 °C

1.586

Safety Information

|H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, P391, and P501|Aggregated GHS information provided by 4 companies from 2 notifications to the ECHA C&L Inventory.

2-Thiopheneethanol, 2-(4-methylbenzenesulfonate) Use and Manufacturing

Intermediate in the preparation of Rotigotine

Computed Properties

Molecular Weight:282.4
XLogP3:3.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:282.03843665
Monoisotopic Mass:282.03843665
Topological Polar Surface Area:80
Heavy Atom Count:18
Complexity:340
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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