MedKoo Cat#: 126579 | Name: Phenylethyl 3-methylcaffeate
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

Phenylethyl 3-methylcaffeate is a caffeic acid ester that has been found in propolis, a resin produced by honeybees, and has anticancer activity

Chemical Structure

Phenylethyl 3-methylcaffeate
Phenylethyl 3-methylcaffeate
CAS#71835-85-3

Theoretical Analysis

MedKoo Cat#: 126579

Name: Phenylethyl 3-methylcaffeate

CAS#: 71835-85-3

Chemical Formula: C18H18O4

Exact Mass: 298.1205

Molecular Weight: 298.34

Elemental Analysis: C, 72.47; H, 6.08; O, 21.45

Price and Availability

Size Price Availability Quantity
50mg USD 350.00 2 Weeks
100mg USD 650.00 2 Weeks
250mg USD 1,050.00 2 Weeks
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Related CAS #
No Data
Synonym
NSC 666255; NSC 671193; Phenethyl Ferulate; 2-Phenylethyl Ferulate; β-Phenethyl Ferulate
IUPAC/Chemical Name
phenethyl (E)-3-(4-hydroxy-3-methoxyphenyl)acrylate
InChi Key
CZQNYPBIOHVQQN-CSKARUKUSA-N
InChi Code
InChI=1S/C18H18O4/c1-21-17-13-15(7-9-16(17)19)8-10-18(20)22-12-11-14-5-3-2-4-6-14/h2-10,13,19H,11-12H2,1H3/b10-8+
SMILES Code
O=C(OCCC1=CC=CC=C1)/C=C/C2=CC=C(O)C(OC)=C2
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 -4 C for short term (days to weeks) or -20 C for long term(months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 298.34 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL