2-Methoxycinnamic acid - CAS 6099-03-2
Catalog: |
BB030888 |
Product Name: |
2-Methoxycinnamic acid |
CAS: |
6099-03-2 |
Synonyms: |
(E)-3-(2-methoxyphenyl)prop-2-enoic acid |
Application: |
(E)-3-(2-Methoxyphenyl)acrylic Acid is a noncompetitive inhibitor of tyrosinase. |
IUPAC Name: | (E)-3-(2-methoxyphenyl)prop-2-enoic acid |
Description: | 2-Methoxycinnamic acid (CAS# 6099-03-2) is a noncompetitive inhibitor of tyrosinase. |
Molecular Weight: | 178.18 |
Molecular Formula: | C10H10O3 |
Canonical SMILES: | COC1=CC=CC=C1C=CC(=O)O |
InChI: | InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6+ |
InChI Key: | FEGVSPGUHMGGBO-VOTSOKGWSA-N |
Boiling Point: | 325.1 °C at 760 mmHg |
Melting Point: | 183-186°C |
Flash Point: | 130.3°C |
Purity: | > 98 % |
Density: | 1.195 g/cm3 |
Solubility: | water, 3971 mg/L @ 25 °C (est) |
Appearance: | Powder |
MDL: | MFCD00064238 |
LogP: | 1.79300 |
Quality Standard: | Enterprise Standard |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
23571415 | 20130601 | Structure-based identification of OATP1B1/3 inhibitors | Molecular pharmacology |
21510660 | 20110517 | Light-responsive threadlike micelles as drag reducing fluids with enhanced heat-transfer capabilities | Langmuir : the ACS journal of surfaces and colloids |
20572266 | 20100801 | Pressurized liquid extraction and GC-MS analysis for simultaneous determination of seven components in Cinnamomum cassia and the effect of sample preparation | Journal of separation science |
18551455 | 20080707 | Efficient synthesis and characterization of new photoactive dextran esters showing nanosphere formation | Macromolecular bioscience |
17243676 | 20070214 | A simple class of photorheological fluids: surfactant solutions with viscosity tunable by light | Journal of the American Chemical Society |
Complexity: | 198 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 178.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.062994177 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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