Methyl acetyl ricinoleate
Product Information
Molecular Formula
C21H38O4
Molecular Weight
354.53
Description
Methyl acetyl ricinoleate is an illustrious biomedical agent that unveils its key role in combatting diverse ailments. It assumes the position of a distinguished constituent within therapeutic entities, namely anti-inflammatory marvels and analgesics, by virtue of its superlative analgesic efficacy.
Synonyms
O-Acetylricinoleic Acid Methyl Ester||||Methyl (Z)-12-Acetoxy-9-octadecenoate
IUPAC Name
methyl (Z,12R)-12-acetyloxyoctadec-9-enoate
SMILES
CCCCCCC(CC=CCCCCCCCC(=O)OC)OC(=O)C
InChI
InChI=1S/C21H38O4/c1-4-5-6-13-16-20(25-19(2)22)17-14-11-9-7-8-10-12-15-18-21(23)24-3/h11,14,20H,4-10,12-13,15-18H2,1-3H3/b14-11-/t20-/m1/s1
InChI Key
CMOYPQWMTBSLJK-ACQXMXPUSA-N
Boiling Point
260 °C/13 mmHg
Melting Point
-26°C
Flash Point
198 °C
Purity
>80.0%(GC)
Density
0.94
Appearance
Colorless to Orange to Green clear liquid
Grade
Industrial grade
Refractive Index
1.46
Safety Information
Hazards
H319:
Causes serious eye irritation.
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
Computed Properties
XLogP3
6.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
18
Exact Mass
354.27700969 g/mol
Monoisotopic Mass
354.27700969 g/mol
Topological Polar Surface Area
52.6Ų
Heavy Atom Count
25
Formal Charge
0
Complexity
363
Isotope Atom Count
0
Defined Atom Stereocenter Count
1
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 |
|---|---|---|
| JP-2017155211-A | Discoloring or discoloring ink composition | 2016-02-26 |
| CN-107406634-A | Rubber composition and pneumatic tire | 2015-04-21 |
| EP-3281978-A1 | Rubber composition and pneumatic tire | 2015-04-21 |
| JP-2016204503-A | Rubber composition and pneumatic tire | 2015-04-21 |
| JP-6030696-B1 | Rubber composition and pneumatic tire | 2015-04-21 |
| US-10632788-B2 | Rubber composition and pneumatic tire | 2015-04-21 |
| US-2018099527-A1 | Rubber composition and pneumatic tire | 2015-04-21 |
| WO-2016171019-A1 | Rubber composition and pneumatic tire | 2015-04-21 |
| CN-107406634-B | Rubber composition and pneumatic tire | 2015-04-21 |
| JP-2016160327-A | Discoloring or discoloring ink composition | 2015-02-27 |
