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Oxymetazoline EP Impurity B HCl

CAT: 1596-AR-O01711-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-O01711-01Size:10 Units
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CAS Number
1218-35-5
Synonyms
2- (4- (tert-butyl) -2,6-dimethylbenzyl) -4,5-dihydro-1H-imidazole hydrochloride;2-[[4- (1,1-Dimethylethyl) -2,6-dimethylphenyl]methyl]-4,5-dihydro-1H-imidazole Hydrochlroide; 2- (4-tert-Butyl-2,6-dimethylbenzyl) -2-imidazoline Monohydrochloride; Brizolin; Galazolin; Neo-Rinoleina; Neo-Synephrine II; Novorin; Olynth; Otrivin Hydrochloride; Therapin; Xymelin; Xylometazoline Hydrochloride; (Xylometazoline HCl)
Molecular Formula
C16H24N2. HCl
Molecular Weight
244.38 36.46
API Name
Oxymetazoline

Chemical Information

Xylometazoline Hydrochloride

See also: Xylometazoline (has active moiety).

CAS Number1218-35-5
PubChem CID5282386
IUPAC Name2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
Molecular FormulaC16H25ClN2
Molecular Weight280.83
Topological Polar Surface Area24.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity302
SMILES
CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.Cl
InChI
InChI=1S/C16H24N2.ClH/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15;/h8-9H,6-7,10H2,1-5H3,(H,17,18);1H
InChIKey
YGWFCQYETHJKNX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Xylometazoline Hydrochloride
CAS: 1218-35-5
CID: 5282386
Formula: C16H25ClN2
MW: 280.83
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight280.83
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count1
Rotatable Bond Count3
Exact Mass280.1706265
Monoisotopic Mass280.1706265
Topological Polar Surface Area24.4 Ų
Heavy Atom Count19
Formal Charge0
Complexity302
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

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