1-Octanol-d2

Modify Date: 2024-01-02 10:17:44

1-Octanol-d2 structure	Common Name	1-Octanol-d2
	CAS Number	78510-02-8	Molecular Weight	132.24000
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₈H₁₆D₂O	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Use of 1-Octanol-d2

1-Octanol-d2 is the deuterium labeled 1-Octanol[1]. 1-Octanol (Octanol), a saturated fatty alcohol, is a T-type calcium channels (T-channels) inhibitor with an IC50 of 4 μM for native T-currents[2]. 1-Octanol is a highly attractive biofuel with diesel-like properties[3].

Name	1-octanol-1,1-d2
Synonym	More Synonyms

Description	1-Octanol-d2 is the deuterium labeled 1-Octanol[1]. 1-Octanol (Octanol), a saturated fatty alcohol, is a T-type calcium channels (T-channels) inhibitor with an IC50 of 4 μM for native T-currents[2]. 1-Octanol is a highly attractive biofuel with diesel-like properties[3].
Related Catalog	Signaling Pathways >> Membrane Transporter/Ion Channel >> Calcium Channel
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]. Joksovic PM, et al. Mechanisms of inhibition of T-type calcium current in the reticular thalamic neurons by 1-octanol: implication of the protein kinase C pathway. Mol Pharmacol. 2010 Jan;77(1):87-94. [3]. Akhtar MK, et al. Microbial production of 1-octanol: A naturally excreted biofuel with diesel-like properties. Metab Eng Commun. 2014 Nov 132:1-5.

Molecular Formula	C₈H₁₆D₂O
Molecular Weight	132.24000
Exact Mass	132.14800
PSA	20.23000
LogP	2.33920

Methyl octylate

CAS#:111-11-5

~99%

1-Octanol-d2

CAS#:78510-02-8

Literature: Landini, Dario; Maia, Angelamaria; Montanari, Fernando; Rolla, Franco Journal of Organic Chemistry, 1983 , vol. 48, # 21 p. 3774 - 3777

Ethyl caprylate

CAS#:106-32-1

~97%

1-Octanol-d2

CAS#:78510-02-8

Literature: Bhar, Palash; Reed, Darwin W.; Covello, Patrick S.; Buist, Peter H. Angewandte Chemie - International Edition, 2012 , vol. 51, # 27 p. 6686 - 6690

Octanoic acid

CAS#:124-07-2

~98%

1-Octanol-d2

CAS#:78510-02-8

Literature: Chen, Hao; Plettner, Erika Journal of Labelled Compounds and Radiopharmaceuticals, 2012 , vol. 55, # 2 p. 66 - 70

Octanoyl chloride

CAS#:111-64-8

~57%

1-Octanol-d2

CAS#:78510-02-8

Literature: Yang, Haishen; Mu, Feng; Wang, Pengfei Journal of Organic Chemistry, 2011 , vol. 76, # 21 p. 8955 - 8961

acetic acid-d

CAS#:758-12-3

Ethyl caprylate

CAS#:106-32-1

1-Octanol-d2

CAS#:78510-02-8

Literature: Luck et al. Journal of the American Chemical Society, 1959 , vol. 81, p. 2784

Precursor 5
CAS#:111-11-5 Methyl octylate CAS#:106-32-1 Ethyl caprylate CAS#:124-07-2 Octanoic acid CAS#:111-64-8 Octanoyl chloride
CAS#:758-12-3 acetic acid-d
DownStream 6
CAS#:111-66-0 octene CAS#:111-65-9 Octane CAS#:13389-42-9 E-2-Octene CAS#:14919-01-8 3-Octene, (3E)-
CAS#:86423-34-9 1-bromooctane-1,1-d2 CAS#:89232-08-6 1-Iodooctane-d2