Basic information
- CAS
125372-42-1- Standard SMILES
O=C(Nc1ccc2c(ccc3oc([N+](=O)[O-])cc32)c1)Nc1ccc2c(ccc3oc([N+](=O)[O-])cc32)c1- InChIKey
XAUYOQKDDNAKJF-UHFFFAOYSA-N- Molecular formula
- C25H14N4O7
- Average molar mass
- 482.4 g/mol
- Monoisotopic mass
- 482.0862488
Names & identifiers
- Preferred name
- N,N'-Bis(2-nitronaphtho(2,1-b)furan-7-yl)urea
- IUPAC
- 1,3-bis(2-nitrobenzo[e][1]benzofuran-7-yl)urea
Names & synonyms
N,N'-Bis(2-nitronaphtho(2,1-b)furan-7-yl)urea125372-42-1N,N'-Bis(2-nitronaphtho[2,1-b]furan-7-yl)ureaDTXSID70925115Urea, N,N'-bis(2-nitronaphtho(2,1-b)furan-7-yl)-
Database identifiers
- CAS
125372-42-1- PubChem CID
- 147883
- DTXSID
DTXSID70925115
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 809
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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