isopentyl p-methoxycinnamate
Product Information
Molecular Formula
C15H20O3
Molecular Weight
248.32
Description
Amiloxate is a cinnamate ester.
Synonyms
3-(4-METHOXY-PHENYL)-ACRYLIC ACID PENTYL ESTER; ISOPENTYL-4-METHOXYCINNAMATE; 2-Propenoicacid,3-(4-methoxyphenyl)-,3-methylbutylester; 3-(4-methoxyphenyl)-2-propenoicaci3-methylbutylester; 3-(4-methoxyphenyl)-2-propenoicacid3-methylbutylester; 3-Methylbutyl3-
IUPAC Name
3-methylbutyl (E)-3-(4-methoxyphenyl)prop-2-enoate
SMILES
CC(C)CCOC(=O)C=CC1=CC=C(C=C1)OC
InChI
InChI=1S/C15H20O3/c1-12(2)10-11-18-15(16)9-6-13-4-7-14(17-3)8-5-13/h4-9,12H,10-11H2,1-3H3/b9-6+
InChI Key
UBNYRXMKIIGMKK-RMKNXTFCSA-N
Boiling Point
362.8°C at 760 mmHg
Melting Point
< -30
Flash Point
152 °C
Purity
95%
Density
1.031 g/cm3
Solubility
water, 4.858 mg/L @ 25 °C (est)
Appearance
Light yellow to Yellow to Orange clear liquid
Refractive Index
1.56
Safety Information
Hazards
H413:
May cause long-lasting harmful effects to aquatic life.
May cause long-lasting harmful effects to aquatic life.
Precautionary Statement
P273:
Avoid release to the environment.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Avoid release to the environment.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
3.9
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
7
Exact Mass
248.14124450 g/mol
Monoisotopic Mass
248.14124450 g/mol
Topological Polar Surface Area
35.5Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
263
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114146010-A | Anhydrous sunscreen gel containing oil-soluble sunscreen agent and preparation method thereof | 2021-12-31 |
| CN-114177111-A | Sunscreen spray and preparation method thereof | 2021-12-20 |
| CN-113952282-A | Composition with whitening and sunscreen effects and preparation method and application thereof | 2021-11-25 |
| DE-202021106362-U1 | Cosmetic preparation for intensive care and treatment of facial skin | 2021-11-22 |
| DE-202021106363-U1 | Cosmetic preparation for the care and treatment of facial skin | 2021-11-22 |
| DE-202021106186-U1 | Cosmetic preparation for care and treatment of periocular skin | 2021-11-11 |
| CN-113876641-A | Cosmetic composition with anti-wrinkle and firming effects and application thereof | 2021-11-05 |
| CN-113730269-A | Mild gel with sun-screening effect and preparation method thereof | 2021-09-29 |
| CN-113786357-A | Gel with sun-proof, instant and long-acting wrinkle-smoothing effects and preparation method thereof | 2021-09-16 |
| CN-113693962-A | Fibronectin-containing multiple protein repair composition and preparation method thereof | 2021-08-09 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22512578 | 2012-07-01 | Antioxidant and antimicrobial activities of cinnamic acid derivatives | Mini reviews in medicinal chemistry |
| 23284607 | 2012-01-01 | UV filters, ingredients with a recognized anti-inflammatory effect | PloS one |
| 21210828 | 2011-02-01 | Photo-allergic contact dermatitis caused by isoamyl p-methoxycinnamate in an 'organic' sunscreen | Contact dermatitis |
| 18826142 | 2008-05-01 | [Analysis of the volatile oils chemical constituents of roots of Actinidia deliciosa] | Zhong yao cai = Zhongyaocai = Journal of Chinese medicinal materials |
