Methyl homoveratrate - CAS 15964-79-1
Catalog: |
BB011558 |
Product Name: |
Methyl homoveratrate |
CAS: |
15964-79-1 |
Synonyms: |
2-(3,4-Dimethoxyphenyl)ethanoic Acid Methyl Ester; 3,4-Dimethoxyphenylacetic Acid Methyl Ester; Homoveratric Acid Methyl Ester; Methyl (3,4-Dimethoxyphenyl)acetate; Benzeneacetic acid, 3,4-dimethoxy-, methyl ester |
IUPAC Name: | methyl 2-(3,4-dimethoxyphenyl)acetate |
Description: | Methyl homoveratrate is an in vivo metabolite of RWJ-26240, a voltage-sensitive calcium channel blocker. Methyl homoveratrate can be identified in plasma, urine and faecal extract. |
Molecular Weight: | 210.23 |
Molecular Formula: | C11H14O4 |
Canonical SMILES: | COC1=C(C=C(C=C1)CC(=O)OC)OC |
InChI: | InChI=1S/C11H14O4/c1-13-9-5-4-8(6-10(9)14-2)7-11(12)15-3/h4-6H,7H2,1-3H3 |
InChI Key: | DILOFCBIBDMHAY-UHFFFAOYSA-N |
Boiling Point: | 285.4±25.0°C at 760 mmHg |
Purity: | ≥97% |
Density: | 1.105±0.06 g/cm3 at 20°C, 760 Torr |
Solubility: | Soluble in Chloroform (Slightly), Methanol (Slightly) |
Appearance: | Colorless Oily Matter |
Storage: | Store at 2-8°C |
LogP: | 1.41930 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021021953-A2 | Dopamine receptor d1 agonists and methods of use | 20190730 |
CN-110128246-A | A kind of preparation method of hydroxytyrosol | 20190610 |
CN-109248707-A | It is a kind of acidity mesopore molecular sieve preparation method and its application in catalytic esterification | 20180820 |
CN-109248707-B | Preparation method of acidic mesoporous molecular sieve and application of acidic mesoporous molecular sieve in catalytic esterification reaction | 20180820 |
US-10513529-B2 | 1,2,4-triazolo-[3,4-b]-1,3,4-thiadiazole derivatives | 20160714 |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.08920892 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.08920892 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 44.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS