Chemical Properties of 1,3,5-Triazine, 1,3,5-triethylhexahydro- (CAS 7779-27-3)

InChI

InChI=1S/C9H21N3/c1-4-10-7-11(5-2)9-12(6-3)8-10/h4-9H2,1-3H3

InChI Key

XYRTVIAPRQLSOW-UHFFFAOYSA-N

Formula

C9H21N3

SMILES

CCN1CN(CC)CN(CC)C1

Molecular Weight¹

171.28

CAS

7779-27-3

Other Names

• s-Triazine, 1,3,5-triethylhexahydro-
• Hexahydro-1,3,5-triethyl-s-triazine
• Triethyltrimethylenetriamine
• Vancide TH
• 1,3,5-Triethylhexahydro-s-triazine
• 1,3,5-Triethylhexahydro-1,3,5-triazine
• 1,3,5-Triethylhexahydro-sym-triazine
• s-Triazine, hexahydro-1,3,5-triethyl-
• hexahydro-1,3,5-triethyl-1,3,5-triazine

• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
IE	[7.40; 8.00]	eV
IE	7.40	eV	NIST
IE	8.00	eV	NIST
log10WS	-0.68		Crippen Calculated Property
logPoct/wat	0.838		Crippen Calculated Property
McVol	156.750	ml/mol	McGowan Calculated Property
Tboil	480.70	K	NIST

Similar Compounds

Find more compounds similar to 1,3,5-Triazine, 1,3,5-triethylhexahydro-.

Sources

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

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