(4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid
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Basic information
- CAS
7150-89-2- Standard SMILES
O=[N+]([O-])OCCOc1ccc([As](=O)(O)O)cc1[N+](=O)[O-]- InChIKey
DKOFTRQOUMOWGK-UHFFFAOYSA-N- Molecular formula
- C8H9AsN2O9
- Average molar mass
- 352.09 g/mol
- Monoisotopic mass
- 351.952399
Names & identifiers
- Preferred name
- (4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acid
- IUPAC
- [3-nitro-4-(2-nitrooxyethoxy)phenyl]arsonic acid
Names & synonyms
7759NTA9H8(4-(2-(Nitrooxy)ethoxy)-3-nitrophenyl)arsonic acidUNII-7759NTA9H8746540-24-97150-89-2Arsonic acid, (4-(2-(nitrooxy)ethoxy)-3-nitrophenyl)-,NSC31815[3-nitro-4-(2-nitrooxyethoxy)phenyl]arsonic acidCHEMBL2008108ANTINEOPLASTIC-525326DTXSID90221727NSC525326
Show more names
NSC-525326NCI60_002731{3-Nitro-4-[2-(nitrooxy)ethoxy]phenyl}arsonic acid
Database identifiers
- CAS
7150-89-2、746540-24-9- PubChem CID
- 352200
- DTXSID
DTXSID90221727- ChEMBL
CHEMBL2008108- UNII
- 7759NTA9H8
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 168 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 400
Related reactions
0 records
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Compound notes
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