Chemical Property of CID 20056052
Chemical Property:
- Melting Point:2402 °C
- Boiling Point:659.4°Cat760mmHg
- PKA:4.11±0.70(Predicted)
- Flash Point:199.6°C
- PSA：100.90000
- Density:1.16g/cm3
- LogP:6.90210
- XLogP3:7.1
- Hydrogen Bond Donor Count:2
- Hydrogen Bond Acceptor Count:6
- Rotatable Bond Count:5
- Exact Mass:568.37638937
- Heavy Atom Count:41
- Complexity:1210
- Purity/Quality:
-
99% *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC=C(C)C(=O)OC1CC(CC2C1(CCC3(C2=CCC4C3(CCC5C4(CCC(=O)C5(C)CO)C)C)C)C(=O)O)(C)C
- Isomeric SMILES:C/C=C(/C)\C(=O)O[C@@H]1CC(C[C@@H]2[C@]1(CC[C@@]3(C2=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CCC(=O)[C@]5(C)CO)C)C)C)C(=O)O)(C)C
