4-Methoxy-2-phosphonobenzoate
Basic information
- CAS
74270-32-9- Standard SMILES
COc1ccc(C(=O)[O-])c(P(=O)(O)O)c1- InChIKey
VCZLDOWWXASGKW-UHFFFAOYSA-M- Molecular formula
- C8H8O6P-
- Average molar mass
- 231.12 g/mol
- Monoisotopic mass
- 231.00584997
Names & identifiers
- Preferred name
- 4-Methoxy-2-phosphonobenzoate
- IUPAC
- 4-methoxy-2-phosphonobenzoate
Names & synonyms
4-methoxy-2-phosphonobenzoateDTXSID40703669
Database identifiers
- CAS
74270-32-9- PubChem CID
- 53471497
- DTXSID
DTXSID40703669
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- -1
- Complexity
- 279
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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