2-Chlorobenzaldehyde → HCID 9890542, 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-(3-Aminopropyl)-2-pyrrolidinone	HCID 82111	—
Reactant	4-Fluoro-3-(trifluoromethyl)benzaldehyde	HCID 522269	—
Product	HCID 9890542	HCID 9890542	—

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 3-(2-oxopyrrolidin-1-yl)propylamine. 1H NMR (CDCl3, 300 MHz) δ 7.78 (s, 1H); 7.53 (d, J=15.6 Hz, 1H); 7.49 (d, J=7.2 Hz, 1H); 7.40-7.33 (m, 3H); 7.14 (m, 1H); 6.80 (d, J=8.2 Hz, 1H); 6.43 (d, J=15.6 Hz, 1H); 3.41 (m, 4H); 3.32 (q, J=6.1 Hz, 2H); 2.43 (t, J=6.6 Hz, 2H); 2.34 (s, 3H), 2.08 (m, 2H), 1.75 (m, 2H). MS (ESI) m/z 947 (2M+Na)+, 925 (2M+H)+, 485 (M+Na)+, 463 (M+H)+.

Provenance & Evidence

DOI	10.6084/m9.figshare.5104873.v1
Patent number	US06867203B2
Source dataset	uspto-grants-2005_03
ORD ID	ord-f8a3e468e8434553bde79c93928b2a0b
Source note	uspto-grants-2005_03