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N-(alpha-Carboxy-2-nitrobenzyl)carbamoylcholine

Base Information
  • Chemical Name:N-(alpha-Carboxy-2-nitrobenzyl)carbamoylcholine
  • CAS No.:117121-25-2
  • Molecular Formula:C16H21F3N3O8+
  • Molecular Weight:0
  • Hs Code.:
  • Mol file:117121-25-2.mol
N-(alpha-Carboxy-2-nitrobenzyl)carbamoylcholine

Synonyms:N-(alpha-carboxy-2-nitrobenzyl)carbamoylcholine;NCNCC

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Chemical Property of N-(alpha-Carboxy-2-nitrobenzyl)carbamoylcholine
Chemical Property:
  • Boiling Point:°Cat760mmHg 
  • Flash Point:°C 
  • PSA:162.24000 
  • Density:g/cm3 
  • LogP:2.51380 
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:11
  • Rotatable Bond Count:7
  • Exact Mass:440.12807412
  • Heavy Atom Count:30
  • Complexity:526
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MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C[N+](C)(C)CCOC(=O)NC(C1=CC=CC=C1[N+](=O)[O-])C(=O)O.C(=O)(C(F)(F)F)O
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