Basic information
- CAS
35422-32-3- Standard SMILES
O=C(O)COc1ccc(Br)cc1C(=O)Nc1ccccc1- InChIKey
WNDFGSDUUTYDTJ-UHFFFAOYSA-N- Molecular formula
- C15H12BrNO4
- Average molar mass
- 350.16 g/mol
- Monoisotopic mass
- 348.99497
Names & identifiers
- Preferred name
- Acetic acid, (4-bromo-2-((phenylamino)carbonyl)phenoxy)-
- IUPAC
- 2-[4-bromo-2-(phenylcarbamoyl)phenoxy]acetic acid
Names & synonyms
Acetic acid, (4-bromo-2-((phenylamino)carbonyl)phenoxy)-35422-32-3(4-Bromo-2-((phenylamino)carbonyl)phenoxy)acetic acidDTXSID90188907RefChem:316251DTXCID10111398[4-bromo-2-(phenylcarbamoyl)phenoxy]acetic acid
Database identifiers
- CAS
35422-32-3- PubChem CID
- 215310
- DTXSID
DTXSID90188907
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 371
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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