Octanoic acid-13C4

Modify Date: 2024-01-05 10:52:46

Octanoic acid-13C4 Structure
Octanoic acid-13C4 structure
Common Name Octanoic acid-13C4
CAS Number 159118-65-7 Molecular Weight 148.18200
Density 0.929 g/mL at 25ºC Boiling Point 237ºC(lit.)
Molecular Formula C413C4H16O2 Melting Point 16ºC(lit.)
MSDS Chinese USA Flash Point >230 °F(lit.)
Symbol GHS05
GHS05
Signal Word Danger

 Use of Octanoic acid-13C4


Octanoic acid-13C4 (Caprylic acid-13C4) is the 13C labeled Octanoic acid. Octanoic acid (Caprylic acid) is an oily liquid with a slightly unpleasant rancid taste and used commercially in the production of esters used in perfumery and also in the manufacture of dyes.

 Names

Name Octanoic acid-1,2,3,4-13C4
Synonym More Synonyms

 Octanoic acid-13C4 Biological Activity

Description Octanoic acid-13C4 (Caprylic acid-13C4) is the 13C labeled Octanoic acid. Octanoic acid (Caprylic acid) is an oily liquid with a slightly unpleasant rancid taste and used commercially in the production of esters used in perfumery and also in the manufacture of dyes.
Related Catalog
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.

 Chemical & Physical Properties

Density 0.929 g/mL at 25ºC
Boiling Point 237ºC(lit.)
Melting Point 16ºC(lit.)
Molecular Formula C413C4H16O2
Molecular Weight 148.18200
Flash Point >230 °F(lit.)
Exact Mass 148.12800
PSA 37.30000
LogP 2.43150
Index of Refraction n20/D 1.428(lit.)

 Safety Information

Symbol GHS05
GHS05
Signal Word Danger
Hazard Statements H314
Precautionary Statements P280-P305 + P351 + P338-P310
Hazard Codes C: Corrosive;
Risk Phrases 34
Safety Phrases 26-27-36/37/39-45
RIDADR UN 3265 8/PG 2
WGK Germany 3

 Synonyms

Caprylic acid-1,2,3,4-13C4
MFCD00209768
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