n-(2-Nitrophenyl)-9h-xanthen-9-amine
Basic information
- CAS
6630-79-1- Standard SMILES
O=[N+]([O-])c1ccccc1NC1c2ccccc2Oc2ccccc21- InChIKey
UOUDUFDHSNINND-UHFFFAOYSA-N- Molecular formula
- C19H14N2O3
- Average molar mass
- 318.3 g/mol
- Monoisotopic mass
- 318.10044231
Names & identifiers
- Preferred name
- n-(2-Nitrophenyl)-9h-xanthen-9-amine
- IUPAC
- N-(2-nitrophenyl)-9H-xanthen-9-amine
Names & synonyms
n-(2-nitrophenyl)-9h-xanthen-9-amine6630-79-1DTXSID20288424RefChem:360965DTXCID60239571NSC55804NCIOpen2_007419NSC-55804
Database identifiers
- CAS
6630-79-1- PubChem CID
- 244706
- DTXSID
DTXSID20288424
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 67.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 430
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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