| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2009 | 31 | No |
Popular Name: 4-Epi-anhydrotetracycline hydrochloride 4-Epi-anhydrotetracycline hydroc…
Find On: PubMed — Wikipedia — Google
CAS Number: 4465-65-0
| 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) | 0.13 | 1.99 | -51.17 | 6 | 9 | 0 | 165 | 426.425 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.13 | 3.8 | -173.6 | 4 | 9 | -2 | 171 | 424.409 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.13 | 0.85 | -111.28 | 4 | 9 | -2 | 167 | 424.409 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.42 | 0.49 | -108.93 | 4 | 9 | -2 | 167 | 424.409 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | 2.71 | -96.45 | 5 | 9 | -1 | 168 | 425.417 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.13 | -0.26 | -52.65 | 5 | 9 | -1 | 164 | 425.417 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.42 | 1.99 | -49.39 | 6 | 9 | 0 | 165 | 426.425 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 220 | Acros Organics |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H302: Harmful if swallowed; H361d: Suspected of damaging the unborn child | Acros Organics |
| P phrase | P281: Use personal protective equipment as required | Acros Organics |
| P phrase | P281: Use personal protective equipment as required; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Ri | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R22: Harmful if swallowed.; R36: Irritating to eyes.; R63: Possible risk of harm to the unborn child. | 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.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
