| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2004 | 10 | Yes |
Popular Name: 1-Hydroxyindan 1-Hydroxyindan
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10/6/6351 12:00:00 AM , 25501-32-0 , 6351-10-6 , 697-64-3
(1R)-2,3-dihydro-1H-inden-1-ol
1-hydroxyhydrindene; 1-indanol; indan-1-ol
1H-Indenol, 2,3-dihydro-; BRN 2042960; EINECS 253-146-4; Indanol; LS-81285
| 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) | 1.39 | 3.04 | -4.03 | 1 | 1 | 0 | 20 | 134.178 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 128?/12mm | Alfa-Aesar |
| Boiling_Point | 128°/12mm | Alfa-Aesar |
| BP | 220 | TCI |
| BP [°C] | 260 | Acros Organics |
| Mp [°C] | 50 - 54 | Acros Organics |
| Melting_Point | 50-54? | Alfa-Aesar |
| Melting_Point | 50-54° | Alfa-Aesar |
| MP | 51-53° | Fluorochem |
| MP | 52 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 97% | Fluorochem |
| UniProt Database Links | AK1C1_HUMAN; AK1C1_MACFA; AK1C1_MACFU; AK1C1_PONAB; AK1C3_HUMAN; AK1C3_PONAB | ChEBI |
| Patent Database Links | EP0867431 | ChEBI |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H302: Harmful if swallowed; H315: Causes skin 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; 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 | 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 | XN: Harmful | Acros Organics |
