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Home > Encyclopedia > [(4-butoxycarbonylphenyl)-butyl-carbamoyl]methyl-butyl-azanium chlorid e

[(4-butoxycarbonylphenyl)-butyl-carbamoyl]methyl-butyl-azanium chlorid e

[(4-butoxycarbonylphenyl)-butyl-carbamoyl]methyl-butyl-azanium chlorid e structure

[(4-butoxycarbonylphenyl)-butyl-carbamoyl]methyl-butyl-azanium chlorid e 

structure
  • CAS No:

    78329-87-0

  • Formula:

    C21H35ClN2O3

  • Chemical Name:

    [(4-butoxycarbonylphenyl)-butyl-carbamoyl]methyl-butyl-azanium chlorid e

  • Synonyms:

    C 3192;p-(N-Butyl-2-(butylamino)acetamido)benzoic acid, butyl ester hydrrochloride;BENZOIC ACID, p-(N-BUTYL-2-(BUTYLAMINO)ACETAMIDO)-, BUTYL ESTER, HYDROCHLORIDE;N-(2-{[4-(Butoxycarbonyl)phenyl](butyl)amino}-2-oxoethyl)-1-butanaminium chloride;CTK9A4862;LS-36343

[(4-butoxycarbonylphenyl)-butyl-carbamoyl]methyl-butyl-azanium chlorid e Basic Attributes

398.972

398.234

Characteristics

63.2

Celiac-rat LD50: 260 mg/kg

Thermal decomposition releases toxic nitrogen oxides and hydrogen chloride fumes

Safety Information

Warehouse ventilation, low temperature and dry

Toxicity

moderately toxic

Computed Properties

Molecular Weight:399.0
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:14
Exact Mass:398.2336207
Monoisotopic Mass:398.2336207
Topological Polar Surface Area:63.2
Heavy Atom Count:27
Complexity:393
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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