| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 28th, 2008 | 5 | Yes |
Popular Name: 1H-Tetrazole 1H-Tetrazole
Find On: PubMed — Wikipedia — Google
CAS Numbers: 288-94-8 , [288-94-8]
| 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) | -0.75 | 0.06 | -33.58 | 0 | 4 | -1 | 53 | 69.047 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 77 | Acros Organics |
| PUBCHEM_PATENT_ID | EP0000100A1; EP0001125A2; EP0002258A2; EP0002586A1; EP0004529A2; EP0005153A1; EP0005200A2; EP0007470A2; EP0007575A1; EP0007588A1; EP0007633A2; EP0008442A2; EP0008649A1; EP0009548A2; EP0009671A2; EP0010061A1; EP0010313A1; EP0010749A1; EP0012230A1; EP001376 | IBM Patent Data |
| PUBCHEM_PATENT_ID | EP0552379B1; US5371100; WO1993003014A1; WO1994002463A1 | IBM Patent Data |
| Patent Database Links | EP0864568; US2005282831; US2006030573; US2006194213; US2007244134; US2007282097; WO2005068410 | ChEBI |
| Hazard | F: Highly flammable | Acros Organics |
| Hazard | F: Highly flammable; XN: Harmful | Acros Organics |
| H phrase | H225: Highly flammable liquid and vapor | Acros Organics |
| H phrase | H225: Highly flammable liquid and vapor; H319: Causes serious eye irritation; H302: Harmful if swallowed; H332: Harmful if inhaled; H312: Harmful in contact with skin | Acros Organics |
| P phrase | P302 + P352: IF ON SKIN: Wash with plenty of soap and water | Acros Organics |
| P phrase | P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P280 | Acros Organics |
| R phrase | R11: Highly flammable. | Acros Organics |
| R phrase | R11: Highly flammable.; R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R36: Irritating to eyes. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking.; S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37: Wear suitable protective clothing and gloves. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.