CAS
944902-03-8 Purity
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944902-03-8 Purity
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Specification
The molecular formula is C7H8ClN3.
It was created on July 21, 2009, and last modified on December 30, 2023.
The IUPAC name is 4-chloro-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine.
The InChI is InChI=1S/C7H8ClN3/c8-7-5-3-9-2-1-6(5)10-4-11-7/h4,9H,1-3H2
The InChIKey is SAAGHRIZYAVSBK-UHFFFAOYSA-N.
It has one hydrogen bond donor count.
The XLogP3-AA value is 0.6.
It has three hydrogen bond acceptor counts.
The topological polar surface area is 37.8 Å2.
Yes, the compound is canonicalized.