| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 14 | Yes |
Popular Name: 4-DIETHYLAMINOBENZOIC ACID 4-DIETHYLAMINOBENZOIC ACID
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5429-28-7 , [5429-28-7]
"4-(Diethylamino)benzoic acid, 99%"
4-(Diethylamino)benzoic acid 99%
4-(Diethylamino)benzoic acid, 99%
4-(N,N-Diethylamino)Benzoic Acid [5429-28-7]
4-(N,N-DIETHYLAMINO)BENZOIC ACID; [5429-28-7]
4-(N-N-Diethylamino)-Benzoic Acid
4-Diethylaminobenzoic acid, 98%
4-Diethylaminosalicylaldehyde [17754-90-4]; (4-Diethylamino-2-hydroxybenzaldehyde)
| 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) | 2.70 | 7.45 | -63.85 | 1 | 3 | 0 | 45 | 193.246 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 192 - 193 | Enamine Building Blocks |
| Mp [°C] | 192 - 195 | Acros Organics |
| MP | 192-193 °C(lit.) | Indofine |
| MP | 192-193° | Oakwood Chemical |
| Melting_Point | 192-195? | Alfa-Aesar |
| MP | 192-195o C | Indofine |
| Melting_Point | 192-195° | Alfa-Aesar |
| MP | 192...193 | Enamine Building Blocks |
| MP | 195 | TCI |
| MP | 60-62 °C(lit.) | Indofine |
| MP | 61-63o C | Indofine |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 97% | APIChem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation | Acros Organics |
| 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 |
| SOLUBILITY | Soluble in Chloroform | Indofine |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.
