4-Ethoxycinnamic acid, predominantly trans - CAS 2373-79-7
Catalog: |
BB018165 |
Product Name: |
4-Ethoxycinnamic acid, predominantly trans |
CAS: |
2373-79-7 |
Synonyms: |
(E)-3-(4-ethoxyphenyl)prop-2-enoic acid |
IUPAC Name: | (E)-3-(4-ethoxyphenyl)prop-2-enoic acid |
Description: | 4-Ethoxycinnamic acid, predominantly trans (CAS# 2373-79-7) is a useful research chemical. |
Molecular Weight: | 192.21 |
Molecular Formula: | C11H12O3 |
Canonical SMILES: | CCOC1=CC=C(C=C1)C=CC(=O)O |
InChI: | InChI=1S/C11H12O3/c1-2-14-10-6-3-9(4-7-10)5-8-11(12)13/h3-8H,2H2,1H3,(H,12,13)/b8-5+ |
InChI Key: | DZLOUWYGNATKKZ-VMPITWQZSA-N |
Boiling Point: | 353.2 ℃ at 760 mmHg |
Melting Point: | 195-199 ℃ |
Purity: | > 98.0 % (GC) (T) |
Density: | 1.161 g/cm3 |
Appearance: | Off-white powder |
MDL: | MFCD00016848 |
LogP: | 2.18310 |
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 |
Publication Number | Title | Priority Date |
WO-2021193349-A1 | Hydrophilic oil repellent polymer | 20200324 |
WO-2021097531-A1 | Polyionic corrosion inhibitors | 20191122 |
WO-2021097532-A1 | Organic corrosion inhibitors | 20191122 |
WO-2020182936-A1 | Sunscreen compositions containing porous metal oxide spheres | 20190312 |
KR-20200135968-A | Cured film forming composition, alignment material, and retardation material | 20180327 |
PMID | Publication Date | Title | Journal |
18956872 | 20081126 | Phenolic derivatives from soy flour ethanol extract are potent in vitro quinone reductase (QR) inducing agents | Journal of agricultural and food chemistry |
Complexity: | 203 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 192.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 192.078644241 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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