1-Propanaminium,3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride (1:1) (461-05-2)

The Carnitine chloride with the cas number 461-05-2, is also called (1)(+-)-Carnitine hydrochloride ; (2)(3-Carboxy-2-hydroxypropyl)trimethylammonium chloride Bicarnesine ; (3)Carnitine DL- HCl ; (4)Carnitine chloride ; (5)Monocamin ; (6)d,l-Carnitine hydrochloride ; (7)1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride; (8)1-Propanaminium, 3-carboxy-2-hydroxy-N,N,N-trimethyl-, chloride (1:1) ; (9)Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, chloride ; (10)Carnitine hydrochloride . It belongs to the following product categories: (1)Fatty & Aliphatic Acids, Esters, Alcohols & Derivatives; (2)Ammonium Chlorides (Quaternary); (3)Quaternary Ammonium Compounds; (4)Amino Acids & Derivatives; (5)Intermediates & Fine Chemicals; (6)Isotope Labeled Compounds; (7)Pharmaceuticals and so on.

Propertes of Carnitine chloride: (1)ACD/LogP: -4.52 ; (2)# of Rule of 5 Violations: 0 ; (3)ACD/LogD (pH 5.5): -3.92 ; (4)ACD/LogD (pH 7.4): -3.92 ; (5)ACD/BCF (pH 5.5): 1 ; (6)ACD/BCF (pH 7.4): 1 ; (7)ACD/KOC (pH 5.5): 1 ; (8)ACD/KOC (pH 7.4): 1 ; (9)#H bond acceptors: 4 ; (10)#H bond donors: 2 ; (11)#Freely Rotating Bonds: 5 ; (12)Polar Surface Area: 35.53??²

The Carnitine chloride is crystalline solid, with slight fishy smell. It is soluble in water, hardly insoluble in Diethyl ether and Acetone, easily become yellow when it is soggy. carnitine hemifumarate is a kind of important nutritional fortifiers and feed additives. Carnitine chloride currently is widely used in feed line, because it can improve the growth of pigs and improve chicken laying rate. the hatched efficiency of egg was increased by using it. It also has obvious effect on reducing fish fat.

The Carnitine chloride can react with propan-2-ol to get DL-carnitine isopropyl ester in HCl for 3 hour(s). Yield is 83 %.

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You can still convert the following datas into molecular structure :
1. SMILES: [Cl-].O=C(O)C[C@H](O)C[N+](C)(C)C
2. InChI: InChI=1/C7H15NO3.ClH/c1-8(2,3)5-6(9)4-7(10)11;/h6,9H,4-5H2,1-3H3;1H/t6-;/m0./s1

The Carnitine chloride toxic data can be showed in the following sheet.

Vitamin (enzyme cofactor). Essential cofactor of fatty acid metabolism; required for the transport of fatty acids through the inner mitochondrial membrane. Synthetized primarily in the liver and kidney; highest concentrations found in heart and skel