| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2008 | 11 | Yes |
Popular Name: 4-(Aminomethyl)benzoic acid 4-(Aminomethyl)benzoic acid
"4-(Aminomethyl)benzoic acid, 98%"
4-(Aminomethyl)benzoic acid, 97%
4-(Aminomethyl)benzoic acid, 99%
4-(aminomethyl)benzoic acid; 56-91-7; nsc41629
56-91-7; Aminomethylbenzoic acid; D07568; Gumbix (TN); p-Aminomethylbenzoic acid
Aminomethylbenzoic Acid; 4-(Aminomethyl)benzoic Ac
Aminomethylbenzoic Acid; 4-(Aminomethyl)benzoic Acid
| 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) | 1.03 | 3.1 | -84.49 | 3 | 3 | 0 | 68 | 151.165 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 100% | Fluorochem |
| MP | 17 - 21 | Enamine Building Blocks |
| MP | 17...21 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | APIChem |
| Mp [°C] | >300 | Acros Organics |
| MP | >300° | Oakwood Chemical |
| Melting_Point | ca 290? dec. | Alfa-Aesar |
| Melting_Point | ca 290° dec. | Alfa-Aesar |
| MP | ca 290°dec | Matrix Scientific |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H315: Causes skin 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.