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63466-71-7

63466-71-7 structure
63466-71-7 structure
  • Name: benzo[a]pyrene-d12
  • Chemical Name: 1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriobenzo[a]pyrene
  • CAS Number: 63466-71-7
  • Molecular Formula: C20D12
  • Molecular Weight: 264.38300
  • Catalog: Chemical reagent Deuterated reagent
  • Create Date: 2018-04-17 08:00:00
  • Modify Date: 2024-01-05 17:26:13
  • Benzo[a]pyrene-d12 is the deuterium labeled Benzo[a]pyrene[1]. Benzo[a]pyrene shows lung carcinogenicity in animal models, and it is frequently used in chemoprevention studies[2][3].

Name 1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriobenzo[a]pyrene
Synonyms Perdeuteriobenzo<a>pyren
3,4-Benzopyrene-d12
Description Benzo[a]pyrene-d12 is the deuterium labeled Benzo[a]pyrene[1]. Benzo[a]pyrene shows lung carcinogenicity in animal models, and it is frequently used in chemoprevention studies[2][3].
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 Feb;53(2):211-216.  

[2]. Saeko Onami, et al. Dosimetry for lung tumorigenesis induced by urethane, 4-(N-methyl-N-nitrosamino)-1-(3-pyridyl)-1-butanone (NNK), and benzo[a]pyrene (B[a]P) in A/JJmsSlc mice. J Toxicol Pathol. 2017 Jul; 30(3): 209–216.  

[3]. Yeo CD, et al. Roflumilast treatment inhibits lung carcinogenesis in benzo(a)pyrene-induced murine lung cancer model. Eur J Pharmacol. 2017 Oct 5812:189  

Density 1.348 g/cm3
Boiling Point 495ºC(lit.)
Melting Point 177-180ºC(lit.)
Molecular Formula C20D12
Molecular Weight 264.38300
Flash Point 228.6ºC
Exact Mass 264.16900
LogP 5.73720
Storage condition 0-6°C
Symbol GHS05 GHS07 GHS08 GHS09
GHS05, GHS07, GHS08, GHS09
Signal Word Danger
Hazard Statements H317-H318-H340-H350-H360FD-H410
Precautionary Statements P201-P280-P305 + P351 + P338 + P310-P308 + P313
Hazard Codes T,N
Risk Phrases R45
Safety Phrases S45-S53-S60-S61
RIDADR UN 3077 9/PG 3
WGK Germany 3