CAS
219763-85-6 Purity
95%
219763-85-6 Purity
95%
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Specification
The molecular formula is C11H13NO2.
The molecular weight is 191.23 g/mol.
The IUPAC name is methyl 1,2,3,4-tetrahydroquinoline-6-carboxylate.
The InChI is InChI=1S/C11H13NO2/c1-14-11(13)9-4-5-10-8(7-9)3-2-6-12-10/h4-5,7,12H,2-3,6H2,1H3.
The InChIKey is PPSPOJUGGLXCIV-UHFFFAOYSA-N.
It has 1 hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.
The topological polar surface area is 38.3 Ų.
No, it has 0 defined atom stereocenters.
Yes, the compound is canonicalized.