trans-9,10-Dihydro-9,10-Dihydroxy-6-Nitrochrysene
[CAS# 117760-92-6]

Identification

• Name: trans-9,10-Dihydro-9,10-Dihydroxy-6-Nitrochrysene
• Synonyms: Trans-9,10-Dihydro-9,10-Dihydroxy-6-Nitrochrysene; 3,4-Chrysenediol, 3,4-Dihydro-12-Nitro-, Trans-; Ccris 3469
• Molecular Formula: C₁₈H₁₃NO₄
• Molecular Weight: 307.31
• CAS Registry Number: 117760-92-6
• SMILES: [C@H]4(O)C1=C(C(=CC2=C1C=CC3=CC=CC=C23)[N+]([O-])=O)C=C[C@@H]4O
• InChI: 1S/C18H13NO4/c20-16-8-7-13-15(19(22)23)9-14-11-4-2-1-3-10(11)5-6-12(14)17(13)18(16)21/h1-9,16,18,20-21H/t16-,18+/m0/s1
• InChIKey: FIVHJEBACQSOKY-FUHWJXTLSA-N

Properties

• Density: 1.509g/cm³ (Cal.)
• Boiling point: 583.136°C at 760 mmHg (Cal.)
• Flash point: 242.54°C (Cal.)