2-Chlorobenzaldehyde → HCID 9846498, compound

Participants

Role	Name	HCID	Charge
Reactant	2-Chlorobenzaldehyde	HCID 6996	—
Reactant	2-Thiocresol	HCID 8712	—
Reactant	6-Amino-1-hexanol	HCID 19960	—
Reactant	2,4-Dichlorobenzenethiol	HCID 70730	—
Reactant	1-Acetylpiperazine	HCID 83795	—
Reactant	4-Fluoro-3-(trifluoromethyl)benzaldehyde	HCID 522269	—
Product	HCID 9846498	HCID 9846498	—

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 1-acetylpiperazine. 1H NMR (CDCl3, 300 MHz) δ 7.79 (s, 1H); 7.63 (d, J=15.4 Hz, 1H); 7.51 (d, J=6.8 Hz, 1H); 7.41-7.33 (m, 3H); 7.28 (m, 1H); 6.83 (d, J=15.4 Hz, 1H); 6.79 (d, J=6.8 Hz, 1H); 3.80-3.60 (m, 6H); 3.57-3.50 (m, 2H); 2.34 (s, 3H); 2.14 (s, 3H). MS (ESI) m/z 919 (2M+Na)+, 897 (2M+H)+, 471 (M+Na)+, 449 (M+H)+.

Provenance & Evidence

DOI	10.6084/m9.figshare.5104873.v1
Patent number	US06867203B2
Source dataset	uspto-grants-2005_03
ORD ID	ord-f882b49abf2f46899d86644fcb2e1149
Source note	uspto-grants-2005_03