| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2004 | 10 | Yes |
Popular Name: Camphene Camphene
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4/7/5794 12:00:00 AM , 5794-03-6 , 5794-04-7 , 79-92-5
(+/-)-Camphene (contains ca. 20% Tricyclene)
(-)-(1S,4R)-camphene; (-)-camphene; CPD-4921
(-)-Camphene, tech. 80% (sum of camphene + fenchene)
(-)-Camphene; (-)-Comphene; C06305
2,2-Dimethyl-3-methylenenorbornane
2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane
79-92-5; C06076; Camphene; Comphene
| 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) | 3.33 | 2.27 | -0.45 | 0 | 0 | 0 | 0 | 136.238 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 159 - 160 | Acros Organics |
| Boiling_Point | 159-160? | Alfa-Aesar |
| Boiling_Point | 159-160° | Alfa-Aesar |
| Mp [°C] | 36 - 38 | Acros Organics |
| MP | 46 | TCI |
| Melting_Point | ca 35? | Alfa-Aesar |
| Melting_Point | ca 35° | Alfa-Aesar |
| PUBCHEM_PATENT_ID | EP0779821A1; EP0963209A2; EP0991427A2; EP1007101A2; US5676925; US5891697; US5990263; US6004969; WO1996007434A1; WO1998018495A2; WO1998018498A2; WO1998018500A2; WO1999015624A1; WO1999053965A1; WO1999055837A2; WO2000044368A1 | IBM Patent Data |
| Patent Database Links | EP1990639; US2007184133; US2007224128; US2007258894; US7288515; WO2007103474 | ChEBI |
| Hazard | F: Highly flammable | Acros Organics |
| Hazard | F: Highly flammable; XI: Irritant; N: Dangerous for the environment | Acros Organics |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H335: May cause respiratory irritation; H315: Causes skin irritation; H410: Very toxic to aquatic life with long lasting effects; H400: Very toxic to aquatic life; H228: Flammable solid | Acros Organics |
| UniProt Database Links | LALIM_LAVAN; PT1_PINTA; TPS3_SOLLC; TPSD6_ABIGR | ChEBI |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P273: Avoid release to the environment; 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: | Acros Organics |
| R phrase | R11: Highly flammable. | Acros Organics |
| R phrase | R11: Highly flammable.; R36/37/38: Irritating to eyes, respiratory system and skin.; R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. | 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.; S29: Do not empty into drains.; S37/39: Wear suitable gloves and eye/face protection.; S57: Use appr | Acros Organics |
| UniProt Database Links | TPS3_SOLLC; TPSD6_ABIGR | ChEBI |
No pre-computed analogs available. Try a structural similarity search.