Basic information
- CAS
58708-48-8- Standard SMILES
Cc1cc(Br)cc(C(=O)NC(O)C(Cl)(Cl)Cl)c1O- InChIKey
LDOHVXBQOJWKSD-UHFFFAOYSA-N- Molecular formula
- C10H9BrCl3NO3
- Average molar mass
- 377.4 g/mol
- Monoisotopic mass
- 374.88314
Names & identifiers
- Preferred name
- 5-Bromo-2-hydroxy-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)benzene-1-carboximidic acid
- IUPAC
- 5-bromo-2-hydroxy-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)benzamide
Names & synonyms
58708-48-8DTXSID409742315-Bromo-2-hydroxy-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)benzene-1-carboximidic acidRefChem:1072714DTXCID3014016625-Bromo-2-hydroxy-3-methyl-N-(2,2,2-trichloro-1-hydroxyethyl)benzamideBRN 2136889BENZAMIDE, 5-BROMO-2-HYDROXY-3-METHYL-N-(2,2,2-TRICHLORO-1-HYDROXYETHYL)-
Database identifiers
- CAS
58708-48-8- PubChem CID
- 42816
- DTXSID
DTXSID40974231
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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