93942-39-3 Purity
96%
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The molecular formula of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is C27H57N3.
The computed molecular weight of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is 423.8 g/mol.
The IUPAC name of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is 1,3,5-tris(2-ethylhexyl)-1,3,5-triazinane.
The Canonical SMILES representation of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is CCCCC(CC)CN1CN(CN(C1)CC(CC)CCCC)CC(CC)CCCC.
The InChIKey of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is IOOQZUUFSICDQX-UHFFFAOYSA-N.
The XLogP3-AA value of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is 9.8.
1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine has 0 hydrogen bond donor counts.
The exact mass of 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is 423.45524883 g/mol.
1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine has 18 rotatable bond counts.
Yes, 1,3,5-Tri(2-ethylhexyl)hexahydro-1,3,5-triazine is considered a canonicalized compound by PubChem.