Quinine urea hydrochloride
CAS Registry Number®
549-52-0
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CAS Name
Quinine urea hydrochlorideMolecular Formula
C20H24N2O2.CH4N2O.2ClHCite this Page
Quinine urea hydrochloride. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=549-52-0 (retrieved ) (CAS RN: 549-52-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
180-190 °C (decomp)
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C20H24N2O2.CH4N2O.ClH/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;2-1(3)4;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H4,2,3,4);1H/t13-,14-,19-,20+;;/m0../s1
InChIKey
InChIKey=VSBIHZIPRXLKFY-HZQSTTLBSA-N
SMILES
[C@@H](O)(C=1C2=C(C=CC(OC)=C2)N=CC1)[C@]3([N@@]4C[C@H](C=C)[C@](C3)(CC4)[H])[H].C(N)(N)=O.Cl
Canonical SMILES
Cl.O=C(N)N.OC(C=1C=CN=C2C=CC(OC)=CC21)C3N4CCC(C3)C(C=C)C4
Other Names for this Substance
- Cinchonan-9-ol, 6′-methoxy-, (8α,9R)-, compd. with urea (1:1), dihydrochloride
- Urea, compd. with quinine (1:1), dihydrochloride, pentahydrate
- Quinine, compd. with urea (1:1), dihydrochloride, pentahydrate
- Urea, compd. with (8α,9R)-6′-methoxycinchonan-9-ol (1:1), dihydrochloride
- Quinine urea hydrochloride
Deleted or Replaced CAS Registry Numbers
6168-97-4, 898817-11-3
