| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 10 | Yes |
Popular Name: 2-Chloroisonicotinamide 2-Chloroisonicotinamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 100859-84-5 , [100859-84-5]
2-(2-Boc-amino)ethoxy-1-iodo-2-(p-tolyl)propane
2-(Boc-amino)ethoxy-1-iodo-2-(4-methylphenyl)propane
2-(Boc-amino)ethoxy-1-iodo-2-(4-methylphenyl)propane, 96%
2-(Boc-amino)ethoxy-1-iodo-2-(p-tolyl)propane
2-chloropyridine-4-carboxamide
2-Chloropyridine-4-carboxamide, 98+%
4-pyridinecarboxamide, 2-chloro-
tert-Butyl 2-[2-iodo-1-methyl-1-(p-tolyl)ethoxy]ethyl carbamate
| 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) | 0.49 | -0.06 | -7.97 | 2 | 3 | 0 | 56 | 156.572 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 198 - 200 | Acros Organics |
| MP | 200 - 202 | Enamine Building Blocks |
| MP | 200...202 | Enamine Building Blocks |
| Melting_Point | 201-203? | Alfa-Aesar |
| MP | 201-203° | Oakwood Chemical |
| MP | 202-205° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H335: May cause respiratory irritation; H319: Causes serious eye 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 |
No pre-computed analogs available. Try a structural similarity search.