Chemical Property of Ccris 6547
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Boiling Point:1547.9°C at 760 mmHg
- PKA:13.38±0.46(Predicted)
- Flash Point:889.9°C
- PSA：374.20000
- Density:1.274g/cm3
- LogP:5.23070
- Storage Temp.:−20°C
- XLogP3:2.2
- Hydrogen Bond Donor Count:14
- Hydrogen Bond Acceptor Count:12
- Rotatable Bond Count:30
- Exact Mass:1105.61851916
- Heavy Atom Count:80
- Complexity:2130
- Purity/Quality:
-
98%,99%, *data from raw suppliers
RC-3095 ≥95% (HPLC), lyophilized powder *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
Total 1 MSDS from other Authors
Useful:
- Canonical SMILES:CC(C)CC(CNC(CC(C)C)C(=O)N)NC(=O)C(CC1=CN=CN1)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(C)NC(=O)C(CC2=CNC3=CC=CC=C32)NC(=O)C(CCC(=O)N)NC(=O)C4CC5=C(CN4)NC6=CC=CC=C56
- Isomeric SMILES:CC(C)C[C@@H](C(=O)N)NCC(CC(C)C)NC(=O)[C@H](CC1=CN=CN1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)C(C)NC(=O)[C@H](CC2=CNC3=CC=CC=C32)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H]4CC5=C(CN4)NC6=CC=CC=C56
