| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 14 | Yes |
Popular Name: (2-methyl-1H-benzimidazol-1-yl)acetic acid (2-methyl-1H-benzimidazol-1-yl)a…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1015533-35-3 , 1177310-33-6 , 40332-17-0 , 4078-55-1 , [40332-17-0]
(2-methyl-1H-benzimidazol-1-yl)acetic acid 0.5 hydrate
(2-methyl-1H-benzimidazol-1-yl)acetic acid hydrochloride hydrate
(2-Methyl-benzoimidazol-1-yl)-acetic acid
(2-methyl-benzoimidazol-1-yl)-aceticacid
(2-Methyl-benzoimidazol-1-yl)acetic acid
1H-Benzimidazole-1-acetic acid, 2-methyl- (9CI)
2-(2-methyl-1H-1,3-benzodiazol-1-yl)acetic acid hydrochloride
2-(2-Methyl-1H-benzo[d]imidazol-1-yl)acetic acid
2-methyl-1H-benzimidazole-1-acetic acid
METHYLBENZOIMIDAZOLYLACETICACI
| 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) | 0.83 | 5.79 | -48.74 | 0 | 4 | -1 | 58 | 189.194 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.02 | 5.29 | -47.99 | 6 | 8 | 1 | 121 | 419.509 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 132 - 134 | Enamine Building Blocks |
| MP | 132...134 | Enamine Building Blocks |
| MP | 138° | Matrix Scientific |
| MP | 193 - 195 | Enamine Building Blocks |
| MP | 193...195 | Enamine Building Blocks |
| MP | 210 - 212 | Enamine Building Blocks |
| MP | 210...212 | Enamine Building Blocks |
| Mp [°C] | 254 - 256 | Acros Organics |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H335: May cause respiratory irritation; H302: Harmful if swallowed; 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; 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 | S22: Do not breathe dust. | Acros Organics |
| S phrase | S22: Do not breathe dust.; 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. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.