Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
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![Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/dc242fdcd6e74d8ca6e67fc3f4f1a4df.png "Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)")
Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
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CAS No:
26162-66-3
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Formula:
C16H25NO3.C6H8O7
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Chemical Name:
Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
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Synonyms:
Phenol,4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-,1-acetate,2-hydroxy-1,2,3-propanetricarboxylate (1:1);Carvacrol,5-[2-(dimethylamino)ethoxy]-,acetate (ester),citrate (1:1);Phenol,4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-,acetate (ester),2-hydroxy-1,2,3-propanetricarboxylate (1:1) (salt);30483-79-5
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CAS No:
Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1) Basic Attributes
471.49812
471.21
247-489-9
DTXSID70180782
Computed Properties
Molecular Weight:471.5
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:11
Exact Mass:471.21044625
Monoisotopic Mass:471.21044625
Topological Polar Surface Area:175
Heavy Atom Count:33
Complexity:544
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Phenol, 4-[2-(dimethylamino)ethoxy]-2-methyl-5-(1-methylethyl)-, 1-acetate, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
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