| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 10th, 2010 | 14 | Yes |
Popular Name: (1S)-(-)-Camphanic acid (1S)-(-)-Camphanic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13429-83-9 , 67111-66-4
(1R)-4,7,7-Trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid
4,7,7-Trimethyl-3-oxo-2-oxa-bicyclo[2.2.1]heptane-1-carboxylic acid
4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid
| 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) | -0.16 | 5.91 | -48.48 | 0 | 4 | -1 | 66 | 197.21 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 198-202? | Alfa-Aesar |
| Melting_Point | 198-202° | Alfa-Aesar |
| Purity | 98% | APIChem |
| PUBCHEM_PATENT_ID | WO2000073796A2 | IBM Patent Data |
No pre-computed analogs available. Try a structural similarity search.