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Home> Encyclopedia > Hot Product Listed 2   > 2-Propanol,1-[[1-(4-amino-4-methylcyclohexyl)-1-methylethyl]amino]-3-[2-(2-propen-1-yl)phenoxy]-
109292-91-3 structure

2-Propanol,1-[[1-(4-amino-4-methylcyclohexyl)-1-methylethyl]amino]-3-[2-(2-propen-1-yl)phenoxy]-

Iupac Name:N-cyclopentyl-9-methylpurin-6-amine
CAS No.:109292-91-3
Molecular Weight:217.2703
Molecular Formula:C12H19CLN2O4 (isomer)
Names and Identifiers
Synonyms

1-(2-allylphenoxy)-3-((1-amino-4-menthane-8-yl)amino)-2-propanol 1-[2-(4-amino-4-methylcyclohexyl)propan-2-ylamino]-3-(2-prop-2-enylphenoxy)propan-2-ol 2-propanol, 1-((1-(4-amino-4-methylcyclohexyl)-1-methylethyl)amino)-3-(2-(2-propenyl)phenoxy)- 2-Propanol,1-[[1-(4-amino-4-methylcyclohexyl)-1-methylethyl]amino]-3-[2-(2-propenyl)phenoxy]-(9CI) CTK5E2695

Inchi
InChI=1/C11H15N5/c1-16-7-14-9-10(12-6-13-11(9)16)15-8-4-2-3-5-8/h6-8H,2-5H2,1H3,(H,12,13,15)
Canonical Smiles
CN1C=NC2=C1N=CN=C2NC3CCCC3
Properties
Density
1.95g/cm3
Boiling Point
329.2°Cat760mmHg
Vapour
1.71E-07mmHg at 25°C
Refractive Index
1.738
Flash Point
25.1°C
Computational chemical data
  • Molecular Weight:217.2703g/mol
  • Molecular Formula:C12H19CLN2O4
  • XLogP3-AA:1.9
  • Exact Mass:217.132746
  • Monoisotopic Mass:217.132746
  • Complexity:241
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:55.6
  • Heavy Atom Count:16
  • 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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