| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 33 | No |
Popular Name: 4-Epichlortetracycline 4-Epichlortetracycline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 101342-45-4 , 14297-93-9
4-Epichlortetracycline hydrochloride, 97%, can be used as secondary standard
C22H23ClN2O8.HCl; Chlortetracycline Hydrochloride; EINECS 222-936-0; LS-174620
| 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) | -0.06 | -0.81 | -55.38 | 7 | 10 | 0 | 186 | 478.885 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.06 | -1.84 | -106.3 | 5 | 10 | -2 | 187 | 476.869 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | -1.66 | -97.77 | 6 | 10 | -1 | 188 | 477.877 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.39 | -3.68 | -114.14 | 5 | 10 | -2 | 187 | 476.869 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.06 | -2.84 | -55.71 | 6 | 10 | -1 | 184 | 477.877 | 2 | ↓ |
| Mid Mid (pH 6-8) | -0.64 | -0.88 | -120.24 | 5 | 10 | -1 | 185 | 477.877 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | >250 | Acros Organics |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H361d: Suspected of damaging the unborn child | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P308 + P313: IF exposed o | Acros Organics |
| P phrase | P281: Use personal protective equipment as required | Acros Organics |
| R phrase | R36: Irritating to eyes. | Acros Organics |
| R phrase | 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 |
