| CAS Number | 1246308-82-6 |
| Catalog Number | AG019F2C |
| Chemical Name | 4-(2-nitrophenyl)-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),3,5,10,12-hexaene |
| IUPAC Name | 2-(2-nitrophenyl)dibenzofuran |
| InChI | InChI=1S/C18H11NO3/c20-19(21)16-7-3-1-5-13(16)12-9-10-18-15(11-12)14-6-2-4-8-17(14)22-18/h1-11H |
| InChI Key | HNGVCNKOEXITNG-UHFFFAOYSA-N |
| MDL Number | MFCD28964844 |
| Molecular Formula | C18H11NO3 |
| Molecular Weight | 289.2848 |
| SMILES | [O-][N+](=O)c1ccccc1-c1ccc2oc3ccccc3c2c1 |
| Synonyms | 2-(2-nitrophenyl)dibenzo[b,d]furan,
1246308-82-6,
SCHEMBL17706812,
MFCD28964844,
ZINC616216155,
CS-0059662,
2-(2-nitrophenyl)Dibenzofuran,
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| Complexity | 421 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 289.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 289.29g/mol |
| Monoisotopic Mass | 289.074g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 59A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number