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1218-35-5

1218-35-5 structural image
Product Name: Xylometazoline hydrochloride
Formula: C16H25ClN2
Synonyms: 2-(4-tert-Butyl-2,6-dimethylbenzyl)-2-imidazoline hydrochloride;Xylometazoline hydrochloride
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CHEMICAL AND PHYSICAL PROPERTIES

Collision Cross Section 168.9 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H301:Acute toxicity,oral
Precautionary Statement Codes P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 280.83 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 3
Exact Mass 280.1706265 g/mol
Monoisotopic Mass 280.1706265 g/mol
Topological Polar Surface Area 24.4 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 302
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

See also: Xylometazoline (has active moiety).

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Pharma Links

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product:Xylometazoline hydrochloride
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