In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 11 | Yes |
Popular Name: 2,4-Dimethylbenzoic acid 2,4-Dimethylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 611-01-8 , N/A , [611-01-8]
"2,4-Dimethylbenzoic acid, 98%"
2,4-Bis(Trifluoromethyl)Benzoic Acid [32890-87-2]
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) | 2.33 | 1.29 | -51.16 | 0 | 2 | -1 | 40 | 149.169 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 122-124° | Oakwood Chemical |
Mp [°C] | 123 - 127 | Acros Organics |
MP | 124 - 126 | Enamine Building Blocks |
Melting_Point | 124-126? | Alfa-Aesar |
Melting_Point | 124-126° | Alfa-Aesar |
MP | 124...126 | Enamine Building Blocks |
MP | 127 | TCI |
BP [°C] | 267 (p=727 torr) | Acros Organics |
Boiling_Point | 267?/727mm | Alfa-Aesar |
Boiling_Point | 267°/727mm | Alfa-Aesar |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95+% | Matrix Scientific |
Purity | 98% | APIChem |
H phrase | H315: Causes skin irritation | Acros Organics |
H phrase | H315: Causes skin irritation; H335: May cause respiratory irritation; H319: Causes serious eye irritation; H302: Harmful if swallowed | 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; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye | 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 |
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 | XN: Harmful | Acros Organics |