CAS 146672-02-8|4-Hydroxybenzoic acid-13c

Introduction:Basic information about CAS 146672-02-8|4-Hydroxybenzoic acid-13c, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name4-Hydroxybenzoic acid-13c
CAS Number146672-02-8Molecular Weight139.11300
Density/Boiling Point/
Molecular FormulaC7H6O3Melting Point214-215ºC(lit.)
MSDSUSAFlash Point/
Symbol
GHS07
Signal WordWarning

Names

Name4-hydroxybenzoic acid
SynonymMore Synonyms

4-Hydroxybenzoic acid-13c BiologicalActivity

Description4-Hydroxybenzoic acid-13C is the 13C labeled 4-Hydroxybenzoic acid[1]. 4-Hydroxybenzoic acid, a phenolic derivative of benzoic acid, could inhibit most gram-positive and some gram-negative bacteria, with an IC50 of 160 μg/mL[2].
Related CatalogResearch Areas >>InfectionSignaling Pathways >>Anti-infection >>Bacterial
In VitroStable 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 Feb;53(2):211-216.  

[2]. Cho JY, Antimicrobial activity of 4-hydroxybenzoic acid and trans 4-hydroxycinnamic acid isolated and identified from rice hull. Biosci Biotechnol Biochem. 1998 Nov;62(11):2273-6.  

Chemical & Physical Properties

Melting Point214-215ºC(lit.)
Molecular FormulaC7H6O3
Molecular Weight139.11300
Exact Mass139.03500
PSA57.53000
LogP1.09040
InChIKeyFJKROLUGYXJWQN-CDYZYAPPSA-N
SMILESO=C(O)c1ccc(O)cc1

Safety Information

Symbol
GHS07
Signal WordWarning
Hazard StatementsH315-H319-H335
Precautionary StatementsP261-P305 + P351 + P338
Hazard CodesXi
RIDADRNONH for all modes of transport

Synonyms

4-Hydroxybenzoic acid-|A-13C
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