usefulchem-molecules

Database of molecules pertinent to Useful Chemistry Project. One molecule per post. Use automation to process whenever possible. We are happy to share compounds that we can spare, as long as their use is reported openly (included failed experiments). NOTE: ANYTHING POSTED HERE IS MADE PUBLIC IMMEDIATELY AND DONATED TO THE PUBLIC DOMAIN . ANYONE MAY USE, EVEN FOR COMMERCIAL PURPOSES, AS LONG AS ATTRIBUTION IS MADE TO THE RELEVANT POSTS IN THIS BLOG.

Wednesday, June 27, 2007

UC0252

Smiles :O=C3NCC(=O)N(Cc1ccco1)C3c2ccccc2
InChI=1/C15H14N2O3/c18-13-9-16-15(19)14(11-5-2-1-3-6-11)17(13)10-12-7-4-8-20-12/h1-8,14H,9-10H2,(H,16,19)

Wednesday, June 20, 2007

UC0251

Smiles :FC(F)(F)C(O2)=CC=C2CN(C(CNC(OC(C)(C)C)=O)=O)C(C(NCC3=CC=CC=C3)=O)C1=CC=CC=C1
InChI=1/C28H30F3N3O5/c1-27(2,3)39-26(37)33-17-23(35)34(18-21-14-15-22(38-21)28(29,30)31)24(20-12-8-5-9-13-20)25
(36)32-16-19-10-6-4-7-11-19/h4-15,24H,16-18H2,1-3H3,(H,32,36)(H,33,37)

Labels: Exp109Ugi

UC0250

Name : [5-(Trifluoromethyl)-2-furylmethylamine
Smiles:FC(F)(F)C1=CC=C(CN)O1
InChI=1/C6H6F3NO/c7-6(8,9)5-2-1-4(3-10)11-5/h1-2H,3,10H2

Thursday, June 14, 2007

UC0249

Smiles :O=C(CNC(=O)OC(C)(C)C)N(Cc1ccco1)C(c2ccccc2)C(=O)NCc3ccccc3
InChI=1/C27H31N3O5/c1-27(2,3)35-26(33)29-18-23(31)30(19-22-15-10-16-34-22)
24(21-13-8-5-9-14-21)25(32)28-17-20-11-6-4-7-12-20/h4-16,24H,17-19H2,1-3H3,(H,28,32)(H,29,33)

Friday, June 08, 2007

UC0248

Name:1-(5-tert-butyl-2-furyl)methanamine
Smiles:CC(C)(C)c1ccc(CN)o1
InChI=1/C9H15NO/c1-9(2,3)8-5-4-7(6-10)11-8/h4-5H,6,10H2,1-3H3