In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 6 | No |
Popular Name: Difluoroacetic acid Difluoroacetic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 381-73-7 , 74956-94-8 , [381-73-7]
AI3-28548; Acetic acid, difluoro-; BRN 1098588; Difluoroacetic acid; EINECS 206-839-0; LS-11716
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 | 1.44 | -39.31 | 0 | 2 | -1 | 40 | 95.024 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 1 | Acros Organics |
MP | 1 - 1 | Enamine Building Blocks |
MP | 1...1 | Enamine Building Blocks |
Melting_Point | 1? | Alfa-Aesar |
Melting_Point | 1° | Alfa-Aesar |
MP | 2 - -1 | Enamine Building Blocks |
MP | 0 | TCI |
BP [°C] | 132 - 134 | Acros Organics |
Boiling_Point | 132-134? | Alfa-Aesar |
Boiling_Point | 132-134° | Alfa-Aesar |
BP | 135 | TCI |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 98% | Matrix Scientific |
Hazard | C: Corrosive | Acros Organics |
Warnings | Corrosive/Lachrymator | Matrix Scientific |
H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
H phrase | H314: Causes severe skin burns and eye damage; H318: Causes serious eye damage | Acros Organics |
Warnings | LACHRYMATOR, CORROSIVE | Matrix Scientific |
P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
P phrase | 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 for several minutes. Remove contact lenses, if present and easy to do. Continue r | Acros Organics |
R phrase | R35: Causes severe burns. | 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.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S45: In case of accident or if you feel unwell, seek medical advice immediat | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.