| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 8 | Yes |
Popular Name: (1-methyl-1H-imidazol-2-yl)methanol (1-methyl-1H-imidazol-2-yl)methanol
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17334-08-6 , 17334-08-6; . , 718642-27-4 , [17334-08-6]
(1-methyl-1H-imidazol-2-yl)methanol hydrochloride
(1-Methyl-2-imidazolyl)methanol
1-Methyl-1H-imidazol-2-yl methanol
1-Methyl-1H-imidazol-2-ylmethanol
1-Methyl-2-imidazolemethanol, 98%
1H-imidazole-2-methanol, 1-methyl-
2-(Hydroxymethyl)-1-methyl-1H-imidazole
| 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) | -0.56 | 0.23 | -9.96 | 1 | 3 | 0 | 38 | 112.132 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.56 | 0.7 | -28.73 | 2 | 3 | 1 | 39 | 113.14 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 107 - 111 | Acros Organics |
| Melting_Point | 107-111? | Alfa-Aesar |
| melting_point | 116 - 119 | KeyOrganics |
| MP | 116-119° | Matrix Scientific |
| MP | 158 - 160 | Enamine Building Blocks |
| MP | 158...160 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| MP | 99 - 101 | Enamine Building Blocks |
| MP | 99...101 | Enamine Building Blocks |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H315: Causes skin irritation; H335: May cause respiratory 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.