Basic information
- CAS
27124-56-7- Standard SMILES
O=C(O)C(Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1- InChIKey
YWZMCFKHSBKVGL-UHFFFAOYSA-N- Molecular formula
- C14H10N2O8
- Average molar mass
- 334.24 g/mol
- Monoisotopic mass
- 334.04371528
Names & identifiers
- Preferred name
- Acetic acid, bis(p-nitrophenoxy)-
- IUPAC
- 2,2-bis(4-nitrophenoxy)acetic acid
- English name
- Bis(p-nitrophenoxy)acetic acid
- Molecular formula
- C14H10N2O8
- Molecular weight
- 334.24
Names & synonyms
Bis(p-nitrophenoxy)acetic acidACETIC ACID, BIS(p-NITROPHENOXY)-BRN 347038027124-56-7DTXSID201815870-06-00-00235 (Beilstein Handbook Reference)RefChem:316560DTXCID60104078BIS(4-NITROPHENOXY)ACETIC ACIDAcetic acid, 2,2-bis(4-nitrophenoxy)-
Database identifiers
- CAS
27124-56-7- PubChem CID
- 33704
- DTXSID
DTXSID20181587- Nikkaji
- J85.197C
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 147 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 422
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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