2,4-Dihydroxycinnamic acid - CAS 614-86-8
Catalog: |
BB031139 |
Product Name: |
2,4-Dihydroxycinnamic acid |
CAS: |
614-86-8 |
Synonyms: |
(E)-3-(2,4-dihydroxyphenyl)prop-2-enoic acid |
IUPAC Name: | (E)-3-(2,4-dihydroxyphenyl)prop-2-enoic acid |
Description: | 2,4-Dihydroxycinnamic acid (CAS# 614-86-8) is a useful research chemical. |
Molecular Weight: | 180.16 |
Molecular Formula: | C9H8O4 |
Canonical SMILES: | C1=CC(=C(C=C1O)O)C=CC(=O)O |
InChI: | InChI=1S/C9H8O4/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+ |
InChI Key: | HGEFWFBFQKWVMY-DUXPYHPUSA-N |
Boiling Point: | 434.5 °C at 760 mmHg |
Melting Point: | 202 °C (dec.) |
Purity: | 95 % |
Appearance: | White to tan powder or crystals |
MDL: | MFCD00463787 |
LogP: | 1.19560 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (97.44%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-112409298-A | Epoxy resin monomer based on p-hydroxy cinnamic acid and preparation method and application thereof | 20201117 |
JP-2020122165-A | Polyamide resin composition | 20200512 |
JP-2021133666-A | On-machine development type lithographic printing plate Original plate, lithographic printing plate manufacturing method, and lithographic printing method | 20200228 |
WO-2021171862-A1 | Lithographic printing plate original plate, lithographic printing plate manufacturing method, and lithographic printing method | 20200228 |
WO-2021132610-A1 | Lithographic printing plate manufacturing method and lithographic printing method | 20191227 |
PMID | Publication Date | Title | Journal |
22652591 | 20120815 | Bio-inspired catechol chemistry for electrophoretic nanotechnology of oxide films | Journal of colloid and interface science |
22168819 | 20120501 | A 2-oxoglutarate-dependent dioxygenase from Ruta graveolens L. exhibits p-coumaroyl CoA 2'-hydroxylase activity (C2'H): a missing step in the synthesis of umbelliferone in plants | The Plant journal : for cell and molecular biology |
21830815 | 20110922 | Curcumin recognizes a unique binding site of tubulin | Journal of medicinal chemistry |
21388814 | 20110401 | Contribution of cinnamic acid analogues in rosmarinic acid to inhibition of snake venom induced hemorrhage | Bioorganic & medicinal chemistry |
11826954 | 20011201 | Induction of 4-hydroxycinnamate decarboxylase in Klebsiella oxytoca cells exposed to substrates and non-substrate 4-hydroxycinnamate analogs | Bioscience, biotechnology, and biochemistry |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 180.04225873 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.04225873 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 77.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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