2-Chlorobenzaldehyde → HCID 9842678, compound

Participants

Role	Name	HCID	Charge
Reactant	2-Chlorobenzaldehyde	HCID 6996	—
Reactant	2-Thiocresol	HCID 8712	—
Reactant	6-Amino-1-hexanol	HCID 19960	—
Reactant	Cyclopropylamine	HCID 69828	—
Reactant	2,4-Dichlorobenzenethiol	HCID 70730	—
Reactant	4-Fluoro-3-(trifluoromethyl)benzaldehyde	HCID 522269	—
Product	HCID 9842678	HCID 9842678	—

Reaction Steps

The title compound was prepared by the procedures described in Example 1 substituting 2,4-dichlorothiophenol with 2-methylthiophenol, 2-chlorobenzaldehyde with 4-fluoro-3-trifluoromethylbenzaldehyde, and 6-amino-1-hexanol with cyclopropylamine. 1H NMR (CDCl3, 300 MHz) δ 7.76 (s, 1H); 7.56 (d, J=15.4 Hz, 1H); 7.50 (d, J=8.4 Hz, 1H); 7.40-7.30 (m, 3H); 7.28 (m, 1H); 6.88 (d, J=8.4 Hz, 1H); 6.30 (d, J=15.4 Hz, 1H); 5.70 (br s, 1H), 2.95 (m, 1H); 2.34 (s, 3H); 0.85 (m, 2H); 0.57 (m, 2H). MS (ESI) m/z 777 (2M+Na)+, 755 (2M+H)+, 400 (M+Na)+, 378 (M+H)+.

Provenance & Evidence

DOI	10.6084/m9.figshare.5104873.v1
Patent number	US06867203B2
Source dataset	uspto-grants-2005_03
ORD ID	ord-ffbd80f786ca4618be46daabdb1a8d2b
Source note	uspto-grants-2005_03