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Dexmedetomidine HCl structure, CAS 145108-58-3

Dexmedetomidine HCl

CAS Number145108-58-3

Synonyms4-[(a-Methyl)-2,3-dimethylbenzyl]imidazole Monohydrochloride; 4-[1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole hydrochloride (1:1); Dexdor; 1H-imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-, monohydrochloride; 5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole,hydrochloride; MFCD07772269; 1H-Imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-, hydrochloride (1:1); UNII:BH210P244U; UNII-1018WH7F9I; 4-[1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole Monohydrochloride; 5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole hydrochloride; Precedex; (S)-4-(1-(2,3-Dimethylphenyl)ethyl)-1H-imidazole Monohydrochloride; 1H-Imidazole, 4-[1-(2,3-dimethylphenyl)ethyl]-, hydrochloride (1:1); Dexmedetomidine HCL; 4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole hydrochloride (1:1); 4-((S)-a,2,3-Trimethylbenzyl)imidazol

Molecular FormulaC13H17ClN2

Molecular Weight236.74

Purity98%

Density

Boiling Point381.9ºC at 760 mmHg

Melting Point153 - 158ºC

Flash Point

Appearance

EINECS

MSDSChineseEnglish

SymbolTransport

Signal WordWarning

Cat. No.: 2A-9010080 Purity: 98%
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Quality Control of [ 145108-58-3 ] Purity: 98% SDS Specification MoL

COA NMR CNMR HPLC LC-MS
Chemical & Physical Properties
CAS Number145108-58-3
Catalog No.2A-9010080
Chinese Name盐酸右美托咪啶
Synonyms4-[(a-Methyl)-2,3-dimethylbenzyl]imidazole Monohydrochloride; 4-[1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole hydrochloride (1:1); Dexdor; 1H-imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-, monohydrochloride; 5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole,hydrochloride; MFCD07772269; 1H-Imidazole, 4-[(1S)-1-(2,3-dimethylphenyl)ethyl]-, hydrochloride (1:1); UNII:BH210P244U; UNII-1018WH7F9I; 4-[1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole Monohydrochloride; 5-[(1S)-1-(2,3-dimethylphenyl)ethyl]-1H-imidazole hydrochloride; Precedex; (S)-4-(1-(2,3-Dimethylphenyl)ethyl)-1H-imidazole Monohydrochloride; 1H-Imidazole, 4-[1-(2,3-dimethylphenyl)ethyl]-, hydrochloride (1:1); Dexmedetomidine HCL; 4-[(1S)-1-(2,3-Dimethylphenyl)ethyl]-1H-imidazole hydrochloride (1:1); 4-((S)-a,2,3-Trimethylbenzyl)imidazol
Molecular FormulaC13H17ClN2
Molecular Weight236.74
Purity98
Boiling Point381.9ºC at 760 mmHg
Melting Point153 - 158ºC
Storage ConditionDesiccate at RT
ApplicationDexmedetomidine hydrochloride is an α2 adrenoceptor agonist with analgesic and sedative activity.
MDL NumberMFCD22683223
SMILES[Cl-].[N+H2]1C=NC=C1[C@@H](C)c2c(c(ccc2)C)C
InChI1S/C13H16N2.ClH/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13;/h4-8,11H,1-3H3,(H,14,15);1H/t11-;/m0./s1
InChI KeyVPNGEIHDPSLNMU-MERQFXBCSA-N
NACRES CodeNA.24
UNSPSC41116107
Hazard SymbolsTransport
MSDSmsds/10080_1_145108_58_3.pdf
BioactivityDexmedetomidine Hydrochloride is an agonist of adrenergic alpha-2 receptor, which is used in veterinary medicine for its analgesic and sedative properties.Target: Adrenergic alpha-2 ReceptorDexmedetomidine, acting at alpha(2A) adrenoceptors, must be present during the encoding process to decrease discrete cue fear memory; however, its ability to suppress contextual memory is likely the result of blocking the consolidation process [1]. Dexmedetomidine had no analgesic effects in alpha(2A)-adrenoceptor KO mice [2]. Dexmedetomidine was effective in blocking these sympathomimetic actions of cocaine even in all 7 subjects who were homozygous for the Del322-325 polymorphism in the alpha2C AR, a loss-of-function mutation that is highly enriched in blacks [3]. Related Catalog Signaling Pathways >> GPCR/G Protein >> Adrenergic Receptor Signaling Pathways >> Autophagy >> Autophagy Research Areas >> Neurological Disease References [1]. Davies, M.F., et al., Activation of alpha2 adrenergic receptors suppresses fear conditioning: expression of c-Fos and phosphorylated CREB in mouse amygdala. Neuropsychopharmacology, 2004. 29(2): p. 229-39. [2]. Ozdogan, U.K., et al., The involvement of alpha 2A-adrenoceptors in morphine analgesia, tolerance and withdrawal in mice. Eur J Pharmacol, 2004. 497(2): p. 161-71. [3]. Menon, D.V., et al., Central sympatholysis as a novel countermeasure for cocaine-induced sympathetic activation and vasoconstriction in humans. J Am Coll Cardiol, 2007. 50(7): p. 626-33. Chemical & Physical Properties Boiling Point 381.9ºC at 760 mmHg Melting Point 153 - 158ºC Molecular Formula C13H17ClN2 Molecular Weight 236.740 Exact Mass 236.108032 PSA 28.68000 LogP 3.98030 Vapour Pressure 1.08E-05mmHg at 25°C InChIKey VPNGEIHDPSLNMU-MERQFXBCSA-N SMILES Cc1cccc(C(C)c2cnc[nH]2)c1C.Cl Storage condition Desiccate at RT
Use ofProperties Articles10 Name dexmedetomidine hydrochloride Synonym More Synonyms Dexmedetomidine hydrochloride Biological Activity Related Catalog Signaling Pathways >> GPCR/G Protein >> Adrenergic Receptor Signaling Pathways >> Autophagy >> Autophagy Research Areas >> Neurological Disease References [1]. Davies, M.F., et al., Activation of alpha2 adrenergic receptors suppresses fear conditioning: expression of c-Fos and phosphorylated CREB in mouse amygdala. Neuropsychopharmacology, 2004. 29(2): p. 229-39. [2]. Ozdogan, U.K., et al., The involvement of alpha 2A-adrenoceptors in morphine analgesia, tolerance and withdrawal in mice. Eur J Pharmacol, 2004. 497(2): p. 161-71. [3]. Menon, D.V., et al., Central sympatholysis as a novel countermeasure for cocaine-induced sympathetic activation and vasoconstriction in humans. J Am Coll Cardiol, 2007. 50(7): p. 626-33. Chemical & Physical Properties Exact Mass 236.108032 PSA 28.68000 LogP 3.98030 InChIKey VPNGEIHDPSLNMU-MERQFXBCSA-N Storage condition Desiccate at RT
Transport InfoShipping Name: UN
MSDS Transport InfoModule 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available
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