| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2004 | 8 | Yes |
Popular Name: Thiazole-5-carboxylic acid Thiazole-5-carboxylic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 14527-41-4 , 26862-80-6 , [14527-41-4]
"Thiazole-5-carboxylic acid, 98%"
1,3-Thiazole-5-carboxylic acid
1,3-Thiazole-5-carboxylic acid 97%
5-Thiazolecarboxylic acid, 98%
| 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) | 0.68 | 1.45 | -47.12 | 0 | 3 | -1 | 53 | 128.132 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 107-108°/10 Torr | Matrix Scientific |
| MP | 169 - 171 | Enamine Building Blocks |
| MP | 169...171 | Enamine Building Blocks |
| MP | 190° | Matrix Scientific |
| MP | 196-197° | Matrix Scientific |
| MP | 217 - 219 | Enamine Building Blocks |
| MP | 347 - 349 | Enamine Building Blocks |
| MP | 347...349 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 97% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0148149A2; EP0148169A2; EP0186463A2; EP0233801A1; EP0238070A2; EP0238070B1; EP0239362A2; EP0239362B1; EP0261503A1; EP0261503B1; EP0296673A1; EP0296673B1; EP0300898A1; EP0300898B1; EP0321115A1; EP0321115B1; EP0335831A1; EP0354201A2; EP0377750A1; EP043648 | IBM Patent Data |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| Warnings | Irritant/Refrigerate | Matrix Scientific |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if presen | Acros Organics |
| R phrase | R36/38: Irritating to eyes and skin. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.