Chemical Property of Nbd-nys-A1
Chemical Property:
- Boiling Point:°Cat760mmHg
- Flash Point:°C
- PSA：414.16000
- Density:1.37g/cm3
- LogP:4.59790
- XLogP3:4.2
- Hydrogen Bond Donor Count:12
- Hydrogen Bond Acceptor Count:24
- Rotatable Bond Count:11
- Exact Mass:1215.60500486
- Heavy Atom Count:86
- Complexity:2290
- Purity/Quality:
-
99% *data from raw suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
-
SDS file from LookChem
Useful:
- Canonical SMILES:CC1C=CC=CCCC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(C(CCC(CC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)NC(=O)CCCCCN(C)C4=CC=C(C5=NON=C45)[N+](=O)[O-])O
- Isomeric SMILES:CC1/C=C/C=C/CC/C=C/C=C/C=C/C=C/C(CC2C(C(CC(O2)(CC(C(CCC(CC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)NC(=O)CCCCCN(C)C4=CC=C(C5=NON=C45)[N+](=O)[O-])O
