Chemical Property of Neocopiamycin A
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Boiling Point:1138.1°C at 760 mmHg
- Flash Point:642.1°C
- PSA：363.33000
- Density:1.29g/cm3
- LogP:3.89050
- XLogP3:3.7
- Hydrogen Bond Donor Count:13
- Hydrogen Bond Acceptor Count:18
- Rotatable Bond Count:15
- Exact Mass:1043.65049851
- Heavy Atom Count:73
- Complexity:1750
- Purity/Quality:
-
95% *data from raw suppliers
NEOCOPIAMYCIN A 95.00% *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1CCC(C(C(CC(C(C=CC(=O)OC(C(C=CC(C(C(CC(CC(CC2CC(C(C(O2)(CC1O)O)O)O)OC(=O)CC(=O)O)O)O)C)O)C)C(C)CC(C)CCCC=CCCCN=C(N)N)C)O)O)C)O
- Isomeric SMILES:CC1CCC(C(C(CC(C(/C=C/C(=O)OC(C(/C=C\C(C(C(CC(CC(CC2CC(C(C(O2)(CC1O)O)O)O)OC(=O)CC(=O)O)O)O)C)O)C)C(C)CC(C)CCC/C=C/CCCN=C(N)N)C)O)O)C)O
