N,N-Diethyl-N-methyl-2-((3-methyl-2-phenylpentanoyl)oxy)ethanaminium bromide
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Product Description
Product
N,N-Diethyl-N-methyl-2-((3-methyl-2-phenylpentanoyl)oxy)ethanaminium bromide
CAS
90-22-2
Formula
C19H32NO2.Br
Synonym
Valethamate bromide; 2-Diethylaminoethyl 2-phenyl-3-methylvalerate methyl bromide; 2-Diethylaminoethyl 3-methyl-2-phenylvalerate methylbromide; 3-Methyl-2-phenylvaleric acid 2-diethylaminoethyl ester methyl bromide; 3-Methyl-2-phenylvaleric acid diethyl(2-hydroxyethyl)methylammonium bromide ester; Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, 3-methyl-2-phenylvalerate; Diethyl(2-hydroxyethyl)methylammonium 3-methyl-2-phenylvalerate bromide; Diethyl(2-hydroxyethyl)methyl-ammonium bromide 3-methyl-2-phenylvalerate; Diethyl(methyl)(2-(3-methyl-2-phenylvaleryloxy)ethyl)ammonium bromide; Ediposin; EINECS 201-977-8; Epidosin; Epidozin; Ethanaminium, 2-((3-methyl-2-phenylvaleryl)oxy)-N,N-diethyl-N-methyl-, bromide (9CI); Murel; N,N-Diethyl-N-methyl-2-((3-methyl-1-oxo-2-phenylpent yl)oxy)ethanaminium; N,N-Diethyl-N-methyl-2-(3-methyl-2-phenylvaleryloxy)ethylammonium bromide; Phenylmethylvaleriansaeure-beta-diaethylaminoaethylester-brommethylat; Phenylmethylvaleriansaeure-beta-diaethylaminoaethylester-brommethylat [German]; Resitan; UNII-6XFR940M2A; Valeric acid, 3-methyl-2-phenyl-, ester with diethyl(2-hydroxyethyl)methylammonium bromide; Valethamate
Typical Product Specifications
Molecular weight
386.37
SMILES
c1([C@@H](C(OCC[N+](CC)(CC)C)=O)[C@@H](CC)C)ccccc1.[BrH-]
InChI
CEJGGHKJHDHLAZ-UHFFFAOYSA-M
InChIKey
1S/C19H32NO2.BrH/c1-6-16(4)18(17-12-10-9-11-13-17)19(21)22-15-14-20(5,7-2)8-3;/h9-13,16,18H,6-8,14-15H2,1-5H3;1H/q+1;/p-1
log P (octanol-water)
1.060
Melting Point
101.5 ° C
Atmospheric OH Rate Constant
4.13E-11 cm3/molecule-sec
Class
N,N-Diethyl-N-methyl-2-((3-methyl-2-phenylpentanoyl)oxy)ethanaminium bromide
Product Description
Product
N,N-Diethyl-N-methyl-2-((3-methyl-2-phenylpentanoyl)oxy)ethanaminium bromide
CAS
90-22-2
Formula
C19H32NO2.Br
Synonym
Valethamate bromide; 2-Diethylaminoethyl 2-phenyl-3-methylvalerate methyl bromide; 2-Diethylaminoethyl 3-methyl-2-phenylvalerate methylbromide; 3-Methyl-2-phenylvaleric acid 2-diethylaminoethyl ester methyl bromide; 3-Methyl-2-phenylvaleric acid diethyl(2-hydroxyethyl)methylammonium bromide ester; Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, 3-methyl-2-phenylvalerate; Diethyl(2-hydroxyethyl)methylammonium 3-methyl-2-phenylvalerate bromide; Diethyl(2-hydroxyethyl)methyl-ammonium bromide 3-methyl-2-phenylvalerate; Diethyl(methyl)(2-(3-methyl-2-phenylvaleryloxy)ethyl)ammonium bromide; Ediposin; EINECS 201-977-8; Epidosin; Epidozin; Ethanaminium, 2-((3-methyl-2-phenylvaleryl)oxy)-N,N-diethyl-N-methyl-, bromide (9CI); Murel; N,N-Diethyl-N-methyl-2-((3-methyl-1-oxo-2-phenylpent yl)oxy)ethanaminium; N,N-Diethyl-N-methyl-2-(3-methyl-2-phenylvaleryloxy)ethylammonium bromide; Phenylmethylvaleriansaeure-beta-diaethylaminoaethylester-brommethylat; Phenylmethylvaleriansaeure-beta-diaethylaminoaethylester-brommethylat [German]; Resitan; UNII-6XFR940M2A; Valeric acid, 3-methyl-2-phenyl-, ester with diethyl(2-hydroxyethyl)methylammonium bromide; Valethamate
Typical Product Specifications
Molecular weight
386.37
SMILES
c1([C@@H](C(OCC[N+](CC)(CC)C)=O)[C@@H](CC)C)ccccc1.[BrH-]
InChI
CEJGGHKJHDHLAZ-UHFFFAOYSA-M
InChIKey
1S/C19H32NO2.BrH/c1-6-16(4)18(17-12-10-9-11-13-17)19(21)22-15-14-20(5,7-2)8-3;/h9-13,16,18H,6-8,14-15H2,1-5H3;1H/q+1;/p-1
log P (octanol-water)
1.060
Melting Point
101.5 ° C
Atmospheric OH Rate Constant
4.13E-11 cm3/molecule-sec
Class
