CAS
95891-30-8 Purity
96%
95891-30-8 Purity
96%
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The molecular formula is C10H16N2O.
The molecular weight is 180.25 g/mol.
The IUPAC name is 2-N-(2-ethoxyethyl)benzene-1,2-diamine.
The InChI is InChI=1S/C10H16N2O/c1-2-13-8-7-12-10-6-4-3-5-9(10)11/h3-6,12H,2,7-8,11H2,1H3.
The Canonical SMILES is CCOCCNC1=CC=CC=C1N.
It has 2 hydrogen bond donor counts.
The exact mass is 180.126263138 g/mol.
It has 5 rotatable bond counts.
The topological polar surface area is 47.3 Ų.
Yes, the compound is canonicalized.