Chemical Properties of Benzyladenine (CAS 1214-39-7)

Benzyladenine

InChI
InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)
InChI Key
NWBJYWHLCVSVIJ-UHFFFAOYSA-N
Formula
C12H11N5
SMILES
c1ccc(CNc2ncnc3[nH]cnc23)cc1
Molecular Weight1
225.25
CAS
1214-39-7
Other Names
  • 124786-41-0
  • 1H-Purin-6-amine, N-(phenylmethyl)-
  • 3458-19-3
  • 6-(N-Benzylamino)purine
  • 6-(benzylamino)purine
  • 6-BA
  • 6-BAP
  • 6-benzyladenine
  • 9H-Purin-6-amine, N-(phenylmethyl)-
  • 9H-Purine, 6-[(phenylmethyl)amino]-
  • ABG 3034
  • Adenine, N-benzyl-
  • BA
  • BA (Growth stimulator)
  • BA (growth stimulant)
  • BAP
  • BAP (growth stimulant)
  • Benzylaminopurine
  • Cytokinin B
  • N-(Phenylmethyl)-1H-purin-6-amine
  • N-(phenylmethyl)-9H-purin-6-amine
  • N-Benzyladenine
  • N-benzyl-9H-purin-6-amine
  • N6-Benzyladenine
  • N6-Benzylaminopurine
  • NSC 40818
  • Pro-Shear
  • SD 4901
  • SQ 4609
  • Verdan senescence inhibitor
  • benzyl(purin-6-yl)amine
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Physical Properties

Property Value Unit Source
IE 8.18 eV Relay (1.0) Calculated Property
log10WS -3.60 Aq. Solubility Prediction
logPoct/wat 1.483 Crippen Calculated Property
McVol 167.160 ml/mol McGowan Calculated Property
Inp 2527.00 NIST
Tfus [503.15; 505.32] K Show Hide
Tfus 503.15 K Thermodynamic models for determination of solid liquid equilibrium of the 6-benzyladenine in pure and binary organic solvents
Tfus 505.32 K Aq. Solubility Prediction

Cheméo can also estimate Normal Boiling Point Temperature, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Similar Compounds

.alpha.-[PURINE-6-YLAMINO]-p-TOLUENESULFONAMIDE. 6-Benzylaminopurine, N-trifluoroacetyl-. Purine, 2,6-bis(benzamido)-. 6-Benzylaminopurine, N-acetyl-. 6-Benzylaminopurine, N,N'-dimethyl-. 6-Benzylaminopurine, N-pentafluoropropionyl-. Adenine, 6-n-benzyl-9-cyclopentyl-. 6-Benzylaminopurine, N-heptafluorobutyryl-. N-(2-Furylmethyl)-N-tert-butyldimethylsilyl-9H-purin-6-amine. 6-Benzylaminopurine, N,N'-di(acetyl)-. (2-Hydroxy-3-phenyl-1,2-dihydroquinoxalin-1-yl)phenyl(3-phenyl-1-benzyl-1,2-dihydroquinoxalin-2-yl)methane. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. risperidone. Argentamin. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate.

Find more compounds similar to Benzyladenine.

Mixtures

Sources

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