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1H-Benzimidazol-2-amine, 1-ethyl-N-[1-(2-propenyl)-4-piperidinyl]-,dinitrate structure
1H-Benzimidazol-2-amine, 1-ethyl-N-[1-(2-propenyl)-4-piperidinyl]-,dinitrate structure

1H-Benzimidazol-2-amine, 1-ethyl-N-[1-(2-propenyl)-4-piperidinyl]-,dinitrate

Iupac Name:3-chloro-2H-thiete 1,1-dioxide
CAS No.:90344-86-8
Molecular Weight:138.565
1. Names and Identifiers
1.1 Name
1H-Benzimidazol-2-amine, 1-ethyl-N-[1-(2-propenyl)-4-piperidinyl]-,dinitrate
1.2 CAS No.
90344-86-8
1.3 CID
332744
1.4 Molecular Formula
C34H36N4 (isomer)
1.5 Inchi
InChI=1S/C3H3ClO2S/c4-3-1-7(5,6)2-3/h1H,2H2
1.6 InChkey
GVIPOINQUFIKHQ-UHFFFAOYSA-N
1.7 Canonical Smiles
C1C(=CS1(=O)=O)Cl
1.8 Isomers Smiles
C1C(=CS1(=O)=O)Cl
2. Properties
3.1 Refractive Index
1.56
3. Computational chemical data
  • Molecular Weight:138.565g/mol
  • Molecular Formula:C34H36N4
  • Compound Is Canonicalized:True
  • XLogP3-AA:0
  • Exact Mass:137.9542282
  • Monoisotopic Mass:137.9542282
  • Complexity:196
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:42.5
  • Heavy Atom Count:7
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
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3-chloro-1,1-dioxido-2H-thiete
  • Purity:99%Packing: 200kg/bag FOB
  • Price:  
  • Time: 2016/07/05
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