Methyl acetyl ricinoleate

Name: Methyl acetyl ricinoleate
Brand: BOC Sciences
Rating: 5 (1 reviews)

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Molecular Formula:

C21H38O4

Molecular Weight:

354.53

CAS Number:

140-03-4

Catalog Number:

BPM-185074

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

Canonical 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.

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.

Computed Properties

XLogP3

6.6

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

354.27700969 g/mol

Monoisotopic Mass

354.27700969 g/mol

Topological Polar Surface Area

52.6Å²

Heavy Atom Count

Formal Charge

Complexity

363

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

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

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Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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