3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihydrochloride
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![3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihydrochloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/fd7a5b6af52d484cb7e5c532722ae151.png "3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihydrochloride")
3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihydrochloride
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CAS No:
63550-80-1
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Formula:
C22H36Cl2N2O5
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Chemical Name:
3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihydrochloride
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Synonyms:
63550-80-1;Breon;DTXSID50979772;Isoetharine mixture with Phenylephrine;1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)butyl)-, hydrochloride, mixt. with (R)-3-hydroxy-alpha-((methylamino)methyl)benzenemethanol hydrochloride;3-[1-Hydroxy-2-(methylamino)ethyl]phenol--4-{1-hydroxy-2-[(propan-2-yl)amino]butyl}benzene-1,2-diol--hydrogen chloride (1/1/2)
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CAS No:
3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol;4-[1-hydroxy-2-(propan-2-ylamino)butyl]benzene-1,2-diol;dihydrochloride Basic Attributes
479.4 g/mol
478.2001276 g/mol
Computed Properties
Molecular Weight:479.4
Hydrogen Bond Donor Count:9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:8
Exact Mass:478.2001276
Monoisotopic Mass:478.2001276
Topological Polar Surface Area:125
Heavy Atom Count:31
Complexity:352
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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