Antineoplastic-44835
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Basic information
- CAS
91461-36-8- Standard SMILES
O=[As](O)(O)c1ccc(N=Cc2ccccc2O)cc1- InChIKey
LQTUXGNPOAVTGO-UHFFFAOYSA-N- Molecular formula
- C13H12AsNO4
- Average molar mass
- 321.16 g/mol
- Monoisotopic mass
- 320.998227
Names & identifiers
- Preferred name
- Antineoplastic-44835
- IUPAC
- [4-[(2-hydroxyphenyl)methylideneamino]phenyl]arsonic acid
Names & synonyms
ANTINEOPLASTIC-4483591461-36-8NSC44835DTXSID10424738NSC-44835(4-{[(E)-(6-Oxocyclohexa-2,4-dien-1-ylidene)methyl]amino}phenyl)arsonic acid
Database identifiers
- CAS
91461-36-8- PubChem CID
- 239597
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 90.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 360
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Related reactions
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Compound notes
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