β-(4-Methylbenzyl)mercapto-β,β-cyclopenta-methylene-propionic acid
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β-(4-Methylbenzyl)mercapto-β,β-cyclopenta-methylene-propionic acid

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Category
Others
Catalog number
BAT-004751
CAS number
87242-91-9
Molecular Formula
C16H22O2S
Molecular Weight
278.41
β-(4-Methylbenzyl)mercapto-β,β-cyclopenta-methylene-propionic acid
IUPAC Name
2-[1-[(4-methylphenyl)methylsulfanyl]cyclohexyl]acetic acid
Synonyms
S-4-Methylbenzyl-pmp; [1-(4-Methyl-Benzylsulfanyl)-Cyclohexyl]-Acetic Acid; Beta-(4-Methylbenzylsulfanyl)-Beta,Beta-Cyclopentamethylene-Propionic Acid
Appearance
White powder
Purity
≥ 99% (TLC)
Melting Point
115-119 °C
Storage
Store at 2-8°C
InChI
InChI=1S/C16H22O2S/c1-13-5-7-14(8-6-13)12-19-16(11-15(17)18)9-3-2-4-10-16/h5-8H,2-4,9-12H2,1H3,(H,17,18)
InChI Key
KNKPWPSQGOXVDF-UHFFFAOYSA-N
Canonical SMILES
CC1=CC=C(C=C1)CSC2(CCCCC2)CC(=O)O
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