(1R)-1-Methylpropyl-4-methylbenzenesulfonate

CAS

61530-30-1

Catalog Number

ACM61530301

Category

Other Products

Molecular Weight

228.31

Molecular Formula

C₁₁H₁₆O₃S

MSDS COA Spec Sheet

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Specification

Synonyms

RARECHEM AK HZ 0029;(R)-2-(4-METHYLPHENYL)SULFONYLOXY-BUTANE;(R)-(-)-1-METHYLPROPYL 4-METHYLBENZENESULFONATE;(1R)-1-METHYLPROPYL-4-METHYLBENZENESULFONATE;(R)-(-)-1-METHYLPROPYL 4-METHYLBENZENE-&;(R)-Butanol-2-(1-p-toluenesulfonate);(R)-(-)- Methylpropyl

IUPAC Name

[(2R)-butan-2-yl]4-methylbenzenesulfonate

Canonical SMILES

CCC(C)OS(=O)(=O)C1=CC=C(C=C1)C

InChI Key

AYHWQTQILBGWRN-SNVBAGLBSA-N

Boiling Point

139-141ºC(lit.)

Flash Point

110ºC

Density

1.12 g/mL at 25 °C(lit.)

Exact Mass

228.08200

Safety Description

S26-S27-S36-S37-S39

Upstream Synthesis Route 1

14898-79-4
98-59-9

61530-30-1

Reference: [1]Yang, Chu-Ting; Han, Jun; Liu, Jun; Li, Yi; Zhang, Fan; Gu, Mei; Hu, Sheng; Wang, Xiaolin
[RSC Advances, 2017, vol. 7, # 40, p. 24652 - 24656]

Downstream Synthesis Route 1

61530-30-1

715-11-7

Reference: [1]Journal of Organic Chemistry,1983,vol. 48,p. 4524 - 4527

Downstream Synthesis Route 2

61530-30-1
74853-07-9

153896-47-0

Reference: [1]Location in patent: scheme or table
Shi, Wei; Nacev, Benjamin A.; Bhat, Shridhar; Liu, Jun O.
[ACS Medicinal Chemistry Letters, 2010, vol. 1, # 4, p. 155 - 159]
[2]Current Patent Assignee: ITALFARMACO SPA - WO2005/40156, 2005, A1
Location in patent: Page/Page column 12
[3]Current Patent Assignee: SCRIPPS RESEARCH - WO2016/94570, 2016, A1
Location in patent: Paragraph 00469

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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