CAS 130048-57-6|(9,9,10,10-2H4)Octadecanoic acid

Introduction：Basic information about CAS 130048-57-6|(9,9,10,10-2H4)Octadecanoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. (9,9,10,10-2H4)Octadecanoic acid BiologicalActivity
3. Chemical & Physical Properties
4. Synonyms

Common Name	(9,9,10,10-2H4)Octadecanoic acid
CAS Number	130048-57-6	Molecular Weight	288.50
Density	0.9±0.1 g/cm3	Boiling Point	359.4±5.0 °C at 760 mmHg
Molecular Formula	C₁₈H₃₂D₄O₂	Melting Point	/
MSDS	/	Flash Point	162.4±12.5 °C

Names

Name	octadecanoic-9,9,10,10-d4 acid
Synonym	More Synonyms

(9,9,10,10-2H4)Octadecanoic acid BiologicalActivity

Description	Stearic acid-d4 is the deuterium labeled Stearic acid. Stearic acid is a long chain dietary saturated fatty acid which exists in many animal and vegetable fats and oils[1].
In Vitro	Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References	[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216. [2]. Shen MC et al. Dietary stearic acid leads to a reduction of visceral adipose tissue in athymic nude mice. PLoS One. 2014 Sep 15;9(9):e104083.

Description

Stearic acid-d4 is the deuterium labeled Stearic acid. Stearic acid is a long chain dietary saturated fatty acid which exists in many animal and vegetable fats and oils[1].

In Vitro

Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].

References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019;53(2):211-216.

[2]. Shen MC et al. Dietary stearic acid leads to a reduction of visceral adipose tissue in athymic nude mice. PLoS One. 2014 Sep 15;9(9):e104083.

Chemical & Physical Properties

Density	0.9±0.1 g/cm3
Boiling Point	359.4±5.0 °C at 760 mmHg
Molecular Formula	C₁₈H₃₂D₄O₂
Molecular Weight	288.50
Flash Point	162.4±12.5 °C
Exact Mass	288.296631
PSA	37.30000
LogP	8.22
Vapour Pressure	0.0±0.8 mmHg at 25°C
Index of Refraction	1.456
InChIKey	QIQXTHQIDYTFRH-YQUBHJMPSA-N
SMILES	CCCCCCCCCCCCCCCCCC(=O)O

Synonyms

9,9,10,10-tetradeuterio-octadecanoic acid

11,11,12,12-tetracyano-1,4-naphthoquinodimethan

9,9,10,10-tetracyanonaphtho-1,4-quinodimethane

(9,9,10,10-H)Octadecanoic acid

11,11,12,12-Tetracyano-1,4-naphthachinondimethan

11.11.12.12-Tetracyano-1.4-naphtha-quinodimethan

11.11.12.12-Tetracyano-1.4-naphthachinodimethan

9,9,10,10-Tetradeuterio-octadecansaeure

11.11.12.12-Tetracyano-1.4-naphthochinodimethan

Octadecanoic-9,9,10,10-d acid

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