| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 12 | Yes |
Popular Name: 2-Chloro-4,5-difluorobenzoic acid 2-Chloro-4,5-difluorobenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 110877-64-0 , 1421761-16-1 , [110877-64-0]
"2-Chloro-4,5-difluorobenzoic acid, 99%"
2-Chloro-4,5-difluorobenzoic acid 99%
2-CHLORO-4,5-DIFLUOROBENZOIC ACID SODIUM SALT
2-Chloro-4,5-Difluorobenzoic Acid [110877-64-0]
2-Chloro-4,5-difluorobenzoic acid, 98%
2-Chloro-4,5-difluorobenzoic acid, 99+%
| 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) | 2.37 | 2.07 | -39.75 | 0 | 2 | -1 | 40 | 191.54 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 103 - 106 | Acros Organics |
| MP | 103-106° | Matrix Scientific |
| MP | 103...106 | Enamine Building Blocks |
| Melting_Point | 104-107? | Alfa-Aesar |
| Melting_Point | 104-107° | Alfa-Aesar |
| MP | 105 | TCI |
| Boiling_Point | 257-259? | Alfa-Aesar |
| Boiling_Point | 257-259° | Alfa-Aesar |
| BP [°C] | 258 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| Purity | 99% | Matrix Scientific |
| H phrase | H312: Harmful in contact with skin | Acros Organics |
| H phrase | H312: Harmful in contact with skin; H314: Causes severe skin burns and eye damage; H317: May cause an allergic skin reaction; H318: Causes serious eye damage | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| 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; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin.; R41: Risk of serious damage to eyes. | 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.