N-BENZYLCINCHONINIUM CHLORIDE

The CAS register number of (9S)-1-Benzyl-9-hydroxycinchonanium chloride is 69221-14-3. It also can be called as Cinchonanium,9-hydroxy-1-(phenylmethyl)-, chloride, (9S)- and the systematic name about this chemical is (9S)-1-benzylcinchonan-1-ium-9-ol chloride. The molecular formula about this chemical is C₂₆H₂₉ClN₂O and the molecular weight is 420.97. It belongs to the following product categories which include Chiral; Alkaloids; Ammonium Chlorides (Quaternary); Asymmetric Synthesis; Biochemistry; Chiral Phase-Transfer Catalysts; Quaternary Ammonium Compounds; Quinoline Alkaloids; Quinolinecarboxylic Acids, etc.; Quinolines; Synthetic Organic Chemistry and so on.

Physical properties about (9S)-1-Benzyl-9-hydroxycinchonanium chloride are: (1)#H bond acceptors: 3; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 33.12Ų.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].C=CC5C[N@+]4(Cc1ccccc1)CC[C@H]5C[C@@H]4[C@@H](O)c2ccnc3ccccc23
(2)InChI: InChI=1/C26H29N2O.ClH/c1-2-20-18-28(17-19-8-4-3-5-9-19)15-13-21(20)16-25(28)26(29)23-12-14-27-24-11-7-6-10-22(23)24;/h2-12,14,20-21,25-26,29H,1,13,15-18H2;1H/q+1;/p-1/t20?,21-,25+,26-,28+;/m0./s1
(3)InChIKey: FCHYSBWCOKEPNQ-WHFRQREHBW
(4)Std. InChI: InChI=1S/C26H29N2O.ClH/c1-2-20-18-28(17-19-8-4-3-5-9-19)15-13-21(20)16-25(28)26(29)23-12-14-27-24-11-7-6-10-22(23)24;/h2-12,14,20-21,25-26,29H,1,13,15-18H2;1H/q+1;/p-1/t20?,21-,25+,26-,28+;/m0./s1
(5)Std. InChIKey: FCHYSBWCOKEPNQ-DUWMGHLWSA-M