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P-Coumaric Acid Ethyl Ester (Standard)

CAT: 0804-HY-N3103RSize: 1 EachDry Ice: NoHazardous: No
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Description
Benazeprilat (Standard) is the analytical standard of Benazeprilat. This product is intended for research and analytical applications. Benazeprilat is an orally active and the active metabolite of benazepril, a carboxyl-containing ACE inhibitor with antihypertensive activity. Benazepril is a well-established antihypertensive agent, both in monoresearch and in combination with other classes of drugs including thiazide diuretics and calcium channel blockers. Benazepril is a first-line research in reducing various pathologies associated with CV risk and secondary end-organ damage[1][2][3].
CAS Number
7362-39-2
Product Name Alternative
Ethyl (E) -p-hydroxycinnamate (Standard) ; Ethyl trans-4-hydroxycinnamate (Standard)
UNSPSC
12352005
Target
Drug Metabolite; Reference Standards
Related Pathways
Metabolic Enzyme/Protease; Others
Field of Research
Inflammation/Immunology
Smiles
CCOC(/C=C/C1=CC=C(O)C=C1)=O
Molecular Formula
C11H12O3
Molecular Weight
192.21
References & Citations
[1]T. Silva, et al. Hydroxycinnamic acid as a novel scaffold for the development of cyclooxygenase-2 inhibitors. RSC Advances. Issue 72, 2015.|[2]Pragasam SJ, et al. Immunomodulatory and anti-inflammatory effect of p-coumaric acid, a common dietary polyphenol on experimental inflammation in rats. Inflammation. 2013 Feb;36 (1) :169-76.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Ethyl coumarate

Ethyl p-coumarate is a cinnamate ester.

CAS Number7362-39-2
PubChem CID676946
IUPAC Nameethyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
Molecular FormulaC11H12O3
Molecular Weight192.21
XLogP2.6
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity203
SMILES
CCOC(=O)/C=C/C1=CC=C(C=C1)O
InChI
InChI=1S/C11H12O3/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-8,12H,2H2,1H3/b8-5+
InChIKey
ZOQCEVXVQCPESC-VMPITWQZSA-N
Chemical Structure
2D Structure
2D structure of Ethyl coumarate
CAS: 7362-39-2
CID: 676946
Formula: C11H12O3
MW: 192.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight192.21
XLogP32.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass192.078644241
Monoisotopic Mass192.078644241
Topological Polar Surface Area46.5 Ų
Heavy Atom Count14
Formal Charge0
Complexity203
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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