Name: Name:Phenethyl methanesulfonate
Brand: AABLOCKS
SKU: AA002CJ0
Rating: 90 (10 reviews)

Catalog No.: AA002CJ0

20020-27-3 | Phenethyl methanesulfonate

Pack Size： 250mg

Purity： 98%

in stock

$40.00 $28.00

Pack Size： 1g

Purity： 98%

in stock

$79.00 $56.00

Pack Size： 5g

Purity： 98%

in stock

$250.00 $175.00

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Technical Information

Catalog Number: AA002CJ0

Chemical Name: Phenethyl methanesulfonate

CAS Number: 20020-27-3

Molecular Formula: C9H12O3S

Molecular Weight: 200.2548

MDL Number: MFCD01715258

SMILES: CS(=O)(=O)OCCc1ccccc1

Properties

Complexity: 222

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 3

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 4

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 1.6

Upstream Synthesis Route

60-12-8

124-63-0

20020-27-3

[1]EuropeanJournalofMedicinalChemistry,2011,vol.46,#7,p.3000-3012

[2]SyntheticCommunications,2011,vol.41,#5,p.748-753

[3]JournalofOrganicChemistry,1993,vol.58,#1,p.272-274

[4]Tetrahedron,2016,vol.72,#49,p.8022-8030

[5]JournalofMedicinalChemistry,1990,vol.33,#10,p.2807-2813

[6]JournalofMedicinalChemistry,1983,vol.26,#1,p.42-50

[7]JournalofChemicalResearch,Miniprint,2000,#6,p.701-715

[8]JournaloftheAmericanChemicalSociety,2014,vol.136,#38,p.13126-13129

[9]Patent:US9255101,2016,B2,.Locationinpatent:Page/Pagecolumn54

[10]Chemistry-AnAsianJournal,2018,vol.13,#3,p.255-260

[11]BioorganicandMedicinalChemistry,2018,vol.26,#12,p.3145-3157

122-78-1

20020-27-3

[1]BioorganicandMedicinalChemistry,2018,vol.26,#12,p.3145-3157

Downstream Synthesis Route

64-17-5

201230-82-2

20020-27-3

2021-28-5

[1]TetrahedronLetters,1991,vol.32,p.3091-3094

20020-27-3

128578-16-5

128577-74-2

[1]JournalofMedicinalChemistry,1990,vol.33,p.2807-2813

20020-27-3

78021-68-8

N-Cyclohexyl-2-(4-hydroxy-1-phenethyl-piperidin-4-yl)-N-methyl-propionamide

[1]JournalofMedicinalChemistry,1983,vol.26,p.42-50

20020-27-3

76031-50-0

73735-12-3

[1]JournalofMedicinalChemistry,1985,vol.28,p.1943-1947

20020-27-3

75979-00-9

73734-48-2

[1]JournalofMedicinalChemistry,1985,vol.28,p.1943-1947

Literature fold

Title: On the role of alkylating mechanisms, O-alkylation and DNA-repair in genotoxicity and mutagenicity of alkylating methanesulfonates of widely varying structures in bacterial systems.

Journal: Chemico-biological interactions20010731

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