| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate ethyl 3,5-dimethyl-1H-pyrrole-2-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 2199-44-2 , [2199-44-2]
"3,5-Dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester, 98%"
1H-pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester
1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-, ethyl ester (9CI)
3,5-Dimethyl-1H-pyrrole-2-carboxylic acid
3,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLIC ACID ETHYL ESTER
3,5-Dimethyl-1H-pyrrole-2-carboxylic acidethyl ester
Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate, 98%
Ethyl 3,5-DiMethyl-2-pyrrolecarboxylate
ethyl 3,5-dimethylpyrrole-2-carboxylate
ethyl-3,5-dimethyl-1h-pyrrole-2-carboxylate
Ethyl3,5-dimethyl-1H-pyrrole-2-carboxylate
| 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) | 1.90 | 4.97 | -6.48 | 1 | 3 | 0 | 42 | 167.208 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 122 - 126 | Acros Organics |
| MP | 124 | TCI |
| mp | 125 - 126 | MolMall (formerly Molecular Diversity Preservation International) |
| MP | 125-126° | Oakwood Chemical |
| MP | 125...126 | Enamine Building Blocks |
| BP [°C] | 135 - 136 (p=10 torr) | Acros Organics |
| BP | 135-136°/10.5mm | Oakwood Chemical |
| BP | 272 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
