3-methoxy-5-[(methylsulfanyl)methyl]-4-(propanoyloxy)benzoic acid



Compound number:
MolPort-035-800-047
IUPAC:
3-methoxy-5-[(methylsulfanyl)methyl]-4-(propanoyloxy)benzoic acid
IUPAC traditional:
3-methoxy-5-[(methylsulfanyl)methyl]-4-(propanoyloxy)benzoic acid
SMILES:
CCC(=O)Oc1c(CSC)cc(cc1OC)C(O)=O
InChI key:
YHBIZRSJYKFODK-UHFFFAOYSA-N
Molecular formula:
C13H16O5S
Molecular weight: 284.33
Solubility: not available


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Supplier Catalogue Data


Catalog: Made to order Ships out: 40 business days Purity: n/a
In warehouse: Made to order
Pack size Ships out Price Qty
1 g September 10, 2020 450.00 USD
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5 g September 10, 2020 1250.00 USD
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10 g September 10, 2020 1750.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-035-800-047

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000226288544
MFCD26525527
3-Methoxy-5-methylsulfanylmethyl-4-propionyloxy-benzoic acid

InChI
InChI: 1S/C13H16O5S/c1-4-11(14)18-12-9(7-19-3)5-8(13(15)16)6-10(12)17-2/h5-6H,4,7H2,1-3H3,(H,15,16)
InChI key: YHBIZRSJYKFODK-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C13H16O5S
Molecular weight: 284.33

Other

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2020 MolPort, v3.79, release date 15-07-2020 11:00 (+0200). All rights reserved.
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