Compound C22H11NO2

2-nitrohexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene

CAS: 81316-87-2

Molecular Formula	`C22H11NO2`
Molecular Weight	321.3 g/mol
LogP	6.9
Topological Polar Surface Area	45.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	2
Rotatable Bonds	0
Exact Mass	321.07898
Heavy Atoms	25
Complexity	571.0

Chemical Identifiers

CAS Number	81316-87-2
SMILES	`C1=CC2=C3C(=C1)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC6=C5C3=C(C=C2)C=C6`
InChIKey	`PEVCOODQXOIYQH-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H11NO2 (CAS: 81316-87-2) is a chemical compound with molecular formula C22H11NO2 and molecular weight 321.3 g/mol. Its IUPAC systematic name is 2-nitrohexacyclo[12.8.0.02,11.03,8.04,21.017,22]docosa-1(14),2(11),3(8),4,6,9,12,15,17(22),18,20-undecaene. LogP 6.9 Topological Polar Surface Area 45.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 2 Rotatable Bonds 0 Exact Mass 321.07898 Heavy Atoms 25 Complexity 571.0 InChI Key: PEVCOODQXOIYQH-UHFFFAOYSA-N. SMILES: C1=CC2=C3C(=C1)C4=C5C(=C(C=C4)[N+](=O)[O-])C=CC6=C5C3=C(C=C2)C=C6.

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