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Home > Encyclopedia > N-Methyl-N-pentyl-β-alanine hydrochloride

N-Methyl-N-pentyl-β-alanine hydrochloride

N-Methyl-N-pentyl-β-alanine hydrochloride structure

N-Methyl-N-pentyl-β-alanine hydrochloride 

structure
  • CAS No:

    625120-81-2

  • Formula:

    C9H19NO2.ClH

  • Chemical Name:

    N-Methyl-N-pentyl-β-alanine hydrochloride

  • Synonyms:

    β-Alanine,N-methyl-N-pentyl-,hydrochloride (1:1);β-Alanine,N-methyl-N-pentyl-,hydrochloride;Ibanic acid hydrochloride;N-Methyl-N-pentyl-β-alanine hydrochloride

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

White Solid

N-Methyl-N-pentyl-β-alanine hydrochloride Basic Attributes

209.71

209.118256

613-046-7

E7FT72BUU1

DTXSID20587383

2922499990

Characteristics

40.5

2.38510

97.0-98.5 °C @ Solvent: Acetone

314.2ºC at 760mmHg

143.8ºC

Safety Information

NONH for all modes of transport

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P201, P202, P261, P264, P271, P272, P273, P280, P281, P302+P352, P304+P340, P305+P351+P338, P308+P313, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

N-Methyl-N-pentyl-β-alanine hydrochloride Use and Manufacturing

Ibandronate intermediate 3-(N-Methylpentylamino)propionic acid hydrochloride is an intermediate in the preparation of biphosphonate drugs used in the prevention and treatment of osteoporosis.

Computed Properties

Molecular Weight:209.71
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:209.1182566
Monoisotopic Mass:209.1182566
Topological Polar Surface Area:40.5
Heavy Atom Count:13
Complexity:126
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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