1,2-Chrysenediol, 1,2-dihydro-5-methyl-6-nitro-, trans-

Base Information

• Chemical Name: 1,2-Chrysenediol, 1,2-dihydro-5-methyl-6-nitro-, trans-
• CAS No.: 105822-91-1
• Molecular Formula: C19H15 N O4
• Molecular Weight: 321.3267
• DSSTox Substance ID: DTXSID90909755
• Wikidata: Q82879416
• Mol file: 105822-91-1.mol

Synonyms:105822-91-1;1,2-Dihydro-5-methyl-6-nitro-1,2-chrysenediol trans-;1,2-Chrysenediol, 1,2-dihydro-5-methyl-6-nitro-, trans-;DTXSID90909755;5-methyl-6-nitro-1,2-dihydrochrysene-1,2-diol

Chemical Property of 1,2-Chrysenediol, 1,2-dihydro-5-methyl-6-nitro-, trans-

Chemical Property:

• Vapor Pressure: 8.04E-15mmHg at 25°C
• Boiling Point: 591.2°Cat760mmHg
• Flash Point: 243.1°C
• Density: 1.461g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 321.10010796
• Heavy Atom Count: 24
• Complexity: 530

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C2=CC=CC=C2C3=C1C4=C(C=C3)C(C(C=C4)O)O)[N+](=O)[O-]
• Isomeric SMILES: CC1=C(C2=CC=CC=C2C3=C1C4=C(C=C3)[C@H]([C@@H](C=C4)O)O)[N+](=O)[O-]