Methylisoeugenol - CAS 93-16-3
Catalog: |
BB040796 |
Product Name: |
Methylisoeugenol |
CAS: |
93-16-3 |
Synonyms: |
Isomethyleugenol; Isoeugenol methyl ether |
Application: |
5-chloro-6-(cyclopropylmethoxy)pyridine-3-carboxylic acid (cas# 1019493-16-3) is a useful research chemical. |
Related CAS: | 54349-79-0
|
IUPAC Name: | 1,2-dimethoxy-4-[(E)-prop-1-enyl]benzene |
Description: | Methylisoeugenol is a natural compound isolated from Acorus tatarinowii. |
Molecular Weight: | 178.23 |
Molecular Formula: | C11H14O2 |
Canonical SMILES: | CC=CC1=CC(=C(C=C1)OC)OC |
InChI: | InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+ |
InChI Key: | NNWHUJCUHAELCL-SNAWJCMRSA-N |
Boiling Point: | 262 °C |
Melting Point: | 62.6°C |
Flash Point: | >230 °F |
Purity: | 98 % |
Density: | 1.053 g/cm3 |
Solubility: | Sealed in dry, Room Temperature |
Appearance: | Liquid |
Storage: | Sealed in dry, Room Temperature |
LogP: | 2.73690 |
Refractive Index: | 1.569 |
GHS Hazard Statement: | Not Classified |
Precautionary Statement: | P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113209203-A | Antiviral compound essential oil and application thereof | 20210518 |
CN-113082158-A | Traditional Chinese medicine composition, preparation method and application thereof | 20210511 |
CN-113092604-A | Rapid detection method for three common anesthetics in aquatic product | 20210318 |
CN-112094118-A | Preparation method of zinc oxide-based ceramic sputtering target material | 20200930 |
CN-111870593-A | Application of trans-methyl isoeugenol in preparing anti-depression drug | 20200812 |
PMID | Publication Date | Title | Journal |
22472106 | 20120614 | Involvement of 5-HT1A in the anxiolytic-like effect of dichloromethane fraction of Pimenta pseudocaryophyllus | Journal of ethnopharmacology |
22280146 | 20120301 | A hexane fraction of guava Leaves (Psidium guajava L.) induces anticancer activity by suppressing AKT/mammalian target of rapamycin/ribosomal p70 S6 kinase in human prostate cancer cells | Journal of medicinal food |
21999530 | 20120101 | Chemical composition, antinociceptive and anti-inflammatory properties of essential oil from the roots of Illicium lanceolatum | Natural product research |
21707253 | 20111201 | Terpenoid composition and antifungal activity of three commercially important essential oils against Aspergillus flavus and Aspergillus niger | Natural product research |
21632962 | 20110901 | Metabolism of methylisoeugenol in liver microsomes of human, rat, and bovine origin | Drug metabolism and disposition: the biological fate of chemicals |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 178.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 178.099379685 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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