| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2005 | 8 | Yes |
Popular Name: 3-Amino-4-methylpyridine 3-Amino-4-methylpyridine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 3430-27-1 , 89808-77-5 , [3430-27-1]
| 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) | 0.73 | 1.37 | -4.78 | 2 | 2 | 0 | 39 | 108.144 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.73 | 1.65 | -28.16 | 3 | 2 | 1 | 40 | 109.152 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 101 - 102 | Acros Organics |
| Melting_Point | 102-106? | Alfa-Aesar |
| Melting_Point | 102-106° | Alfa-Aesar |
| MP | 102-107° | Oakwood Chemical |
| MP | 105 - 107 | Enamine Building Blocks |
| MP | 105...107 | Enamine Building Blocks |
| MP | 106 | TCI |
| BP | 254 | TCI |
| Boiling_Point | 254? | Alfa-Aesar |
| Boiling_Point | 254° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Matrix Scientific |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| H phrase | H314: Causes severe skin burns and eye damage; H302: Harmful if swallowed; H335: May cause respiratory irritation; H318: Causes serious eye damage; H312: Harmful in contact with skin | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | Acros Organics |
| R phrase | R21/22: Harmful in contact with skin and if swallowed. | Acros Organics |
| R phrase | R21/22: Harmful in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin.; R41: Risk of serious damage to eyes. | 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 |
| Warnings | TOXIC | Matrix Scientific |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.