Chemical Properties of Trimethylzeatin (CAS 62747-81-3)

InChI

InChI=1S/C13H19N5O/c1-10(7-19-4)5-6-17(2)12-11-13(15-8-14-12)18(3)9-16-11/h5,8-9H,6-7H2,1-4H3/b10-5+

InChI Key

DPZJINNFLYQJJE-BJMVGYQFSA-N

Formula

C13H19N5O

SMILES

COCC(C)=CCN(C)c1ncnc2c1ncn2C

Molecular Weight¹

261.32

CAS

62747-81-3

Other Names

• N-[(2E)-4-Methoxy-3-methyl-2-butenyl]-N,9-dimethyl-9H-purin-6-amine
• trans-Zeatin, permethylated
• 9H-Purin-6-amine, N-(4-methoxy-3-methyl-2-butenyl)-N,9-dimethyl-, (E)-
• trans-Zeatin, N,9-dimethyl-, methyl ether

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-4.80		Crippen Calculated Property
logPoct/wat	1.392		Crippen Calculated Property
McVol	206.580	ml/mol	McGowan Calculated Property
Inp	[2299.00; 2304.00]
Inp	2299.00		NIST
Inp	2304.00		NIST
Inp	2304.00		NIST
Inp	2299.00		NIST

Similar Compounds

Find more compounds similar to Trimethylzeatin.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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