CAS
915921-99-2 Purity
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915921-99-2 Purity
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Specification
The molecular formula is C8H13N3.
It was created on May 28, 2009, and last modified on December 30, 2023.
The IUPAC Name is N'-(3-methylpyridin-4-yl)ethane-1,2-diamine.
The InChIKey is OKUXSALAQVZSJX-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C(C=CN=C1)NCCN.
The molecular weight is 151.21 g/mol.
It has 2 hydrogen bond donor counts.
The topological polar surface area is 50.9 Å2.
It has 3 rotatable bond counts.
Yes, it is considered as a canonicalized compound.