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Methyl p-coumarate

CAT: 0013-GTR19171611-01Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19171611-01Size:1 ml x 10 mM (in DMSO)
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Description
Methyl 4-hydroxycinnamate is a methyl ester derivative of p-coumaric acid, sourced from Trixis michuacana var. longifolia. It demonstrates antibacterial activity and inhibits melanogenesis, making it a candidate for research in microbiology and dermatology, including studies on skin pigmentation disorders.
CAS Number
3943-97-3
Product Name Alternative
B16, A. alternata, Inhibitor, melanin, melanoma, formation, Fungal, inhibit, longifolia, Methyl p coumarate, Methyl pcoumarate, Methyl p-coumarate, Methyl 4-hydroxycinnamate, michuacana, pathogens, Trixis
Field of Research
Infectious Disease & Virology
Purity
99.27% (May vary between batches)
Solubility
DMSO:55 mg/mL (308.68 mM)
Smiles
O=C (OC) C=CC1=CC=C (O) C=C1
Molecular Formula
C10H10O3
Molecular Weight
178.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Methyl p-coumarate

methyl hydroxycinnamate has been reported in Alpinia blepharocalyx, Gmelina asiatica, and other organisms with data available.

CAS Number3943-97-3
PubChem CID92203
IUPAC Namemethyl 3-(4-hydroxyphenyl)prop-2-enoate
Molecular FormulaC10H10O3
Molecular Weight178.18
XLogP2.3
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity190
SMILES
COC(=O)C=CC1=CC=C(C=C1)O
InChI
InChI=1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3
InChIKey
NITWSHWHQAQBAW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl p-coumarate
CAS: 3943-97-3
CID: 92203
Formula: C10H10O3
MW: 178.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight178.18
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass178.062994177
Monoisotopic Mass178.062994177
Topological Polar Surface Area46.5 Ų
Heavy Atom Count13
Formal Charge0
Complexity190
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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