1398065-74-1

1398065-74-1 structure
1398065-74-1 structure
  • Name: Monooctyl phthalate-d4
  • Chemical Name: 2-[(Octyloxy)carbonyl](2H4)benzoic acid
  • CAS Number: 1398065-74-1
  • Molecular Formula: C16H18D4O4
  • Molecular Weight: 282.37
  • Catalog: Research Areas Infection
  • Create Date: 2018-07-14 08:02:31
  • Modify Date: 2025-08-25 19:02:04
  • Monooctyl phthalate-d4 (Mono-n-octyl phthalate-d4) is a deuterium labeled Monooctyl phthalate (HY-133671). Monooctyl phthalate (Mono-n-octyl phthalate) exhibits antimycobacterial activity with a MIC of 20 μg/mL[1][2].

Name 2-[(Octyloxy)carbonyl](2H4)benzoic acid
Synonyms 1,2-Benzene-d4-dicarboxylic acid, monooctyl ester
2-[(Octyloxy)carbonyl](2H4)benzoic acid
Description Monooctyl phthalate-d4 (Mono-n-octyl phthalate-d4) is a deuterium labeled Monooctyl phthalate (HY-133671). Monooctyl phthalate (Mono-n-octyl phthalate) exhibits antimycobacterial activity with a MIC of 20 μg/mL[1][2].
Related Catalog
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-246.  

[2]. Muniyan Rajiniraja, et al.In vitro inhibition potential of mono-n-octyl phthalate on Mycobacterium tuberculosis H37Ra: Possibility of binding to mycobacterial PknB-An in silico approach. Biotechnol Appl Biochem. 2018 Nov;65(6):865-875.  

Density 1.1±0.1 g/cm3
Boiling Point 414.4±28.0 °C at 760 mmHg
Molecular Formula C16H18D4O4
Molecular Weight 282.37
Flash Point 146.5±17.5 °C
Exact Mass 282.176910
LogP 4.85
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.518
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