Chemical Property of Conodurine B640243K102
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Chemical Property:
- Melting Point:222-225 °C (decomp)
- Boiling Point:°Cat760mmHg
- PKA:17.01±0.60(Predicted)
- Flash Point:°C
- PSA:99.89000
- Density:1.3g/cm3
- LogP:6.36470
- XLogP3:6.1
- Hydrogen Bond Donor Count:2
- Hydrogen Bond Acceptor Count:7
- Rotatable Bond Count:7
- Exact Mass:704.39377077
- Heavy Atom Count:52
- Complexity:1410
- Purity/Quality:
-
99%, *data from raw suppliers
CONODURINE 95.00% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=CC(=C5C6CC7C(C(CC8=C6NC9=CC=CC=C89)N(CC7=CC)C)C(=O)OC)OC)C(=O)OC
- Isomeric SMILES:CCC1CC2CC3(C1N(C2)CCC4=C3NC5=C4C=CC(=C5C6CC\7C(C(CC8=C6NC9=CC=CC=C89)N(C/C7=C\C)C)C(=O)OC)OC)C(=O)OC