Cinchonine hydrochloride

Cinchonine hydrochloride

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Catalog Number ACM5949111
CAS Number 5949-11-1
Structure
Synonyms Cinchonan-9(S)-ol monohydrochloride
Molecular Weight 330.8
Molecular Formula C19H22N2O.HCl
InChI InChI=1S/C19H22N2O.ClH/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17;/h2-7,9,13-14,18-19,22H,1,8,10-12H2;1H/t13-,14-,18+,19-;/m0./s1
InChI Key IMUHWLVEEVGMBC-BKUXTCEESA-N
Melting Point 208-218 °C
Purity 98%+
Appearance crystals
Complexity 412
Covalently-Bonded Unit Count 2
Defined Atom Stereocenter Count 4
Exact Mass 330.1498911
Heavy Atom Count 23
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
Isomeric SMILES C=C[C@H]1CN2CC[C@H]1C[C@@H]2[C@H](C3=CC=NC4=CC=CC=C34)O.Cl
Monoisotopic Mass 330.1498911
PhysicalState Solid
Rotatable Bond Count 3
Topological Polar Surface Area 36.4 Ų

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