In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 17 | Yes |
Popular Name: 2-(4-chlorobenzyl)-4-methyl-1,3-thiazole-5-carboxylic acid 2-(4-chlorobenzyl)-4-methyl-1,3-…
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CAS Numbers: 938001-17-3 , N/A
2-(4-chlorobenzyl)-4-methyl-1,3-thiazole-5-carboxylicacid
2-(4-Chlorobenzyl)-4-methylthiazole-5-carboxylic acid
2-[(4-chlorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxylic acid
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.27 | -0.65 | -48.14 | 0 | 3 | -1 | 53 | 266.729 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 243 - 245 | KeyOrganics |
MP | 243-245° | Matrix Scientific |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |