| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 11 | Yes |
Popular Name: 4-Vinylbenzoic acid 4-Vinylbenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1075-49-6 , [1075-49-6]
4-Vinylbenzoic Acid (stabilized with BHT)
4-Vinylbenzoic acid, 96%, stabilized
| 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 | 1.55 | -51.01 | 0 | 2 | -1 | 40 | 147.153 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 6.96 | -14.62 | 0 | 11 | 0 | 116 | 451.516 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 142 - 144 | Acros Organics |
| MP | 142...144 | Enamine Building Blocks |
| MP | 143-144° | Matrix Scientific |
| purity | 9.500000000000000e+001 | Enamine Building Blocks |
| Purity | 92% | Matrix Scientific |
| purity | 95 | Enamine Building Blocks |
| Purity | 97% | Matrix Scientific |
| Melting_Point | ca 142? | Alfa-Aesar |
| Melting_Point | ca 142° | Alfa-Aesar |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H315: Causes skin irritation | Acros Organics |
| Warnings | IRRITANT, KEEP COLD | Matrix Scientific |
| Warnings | Irritant/Store in Freezer | 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 |
