| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 12 | Yes |
Popular Name: ethyl 5-amino-1-methyl-1H-pyrazole-4-carboxylate ethyl 5-amino-1-methyl-1H-pyrazo…
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CAS Numbers: 1955554-71-8 , 23286-70-6 , 31037-02-2 , 313037-02-2 , [23286-70-6]
5-Amino-1-methyl-1H-pyrazole-4-carboxylic acid ethyl ester
Ethyl 1-methyl-5-amino pyrozole carboxylate
Ethyl 5-amino-1-methyl-1H-pyrazole-4-carboxylate, 98%
Ethyl 5-amino-1-methylpyrazole-4-carboxylate
Ethyl 5-amino-1-methylpyrazole-4-carboxylate, 98%
Ethyl 5-amino-3-methyl-1H-pyrazole-4-carboxylate
ethyl-3-imino-2-methyl-2,3-dihydro-1H-pyrazole-4-carboxylate
ethyl-5-amino-1-methyl-1H-pyrazole-4-carboxylate
Ethyl5-Amino-1-Methylpyrazole-4-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) | 0.13 | 2.82 | -7.85 | 2 | 5 | 0 | 70 | 169.184 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 101 - 102 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| MP | 95 - 97 | Enamine Building Blocks |
| MP | 95-100° | Oakwood Chemical |
| MP | 95-97° | Matrix Scientific |
| MP | 95...97 | Enamine Building Blocks |
| Melting_Point | 97-102? | Alfa-Aesar |
| Melting_Point | 97-102° | Alfa-Aesar |
| Mp [°C] | 98 - 102 | Acros Organics |
| Purity | 98% | Matrix Scientific |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H315: Causes skin 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 | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S22: Do not breathe dust. | Acros Organics |
| S phrase | S22: Do not breathe dust.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. | 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 |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.