| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2005 | 11 | Yes |
Popular Name: 4-Iodophenylacetic acid 4-Iodophenylacetic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1798-06-7 , 6/7/1798 , [1798-06-7]
| 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) | 2.44 | 0.2 | -43.54 | 0 | 2 | -1 | 40 | 261.038 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 1.81 | -6.33 | 2 | 2 | 0 | 40 | 212.314 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 134 - 136 | Enamine Building Blocks |
| MP | 134-136° | Matrix Scientific |
| MP | 134...136 | Enamine Building Blocks |
| Melting_Point | 136-140? | Alfa-Aesar |
| Melting_Point | 136-140° | Alfa-Aesar |
| MP | 140-141° | Oakwood Chemical |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Matrix Scientific |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| Warnings | IRRITANT, LIGHT SENSITIVE | Matrix Scientific |
| Warnings | Irritant/Light Sensitive | 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; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P305 + P35 | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
