261952-20-9 Purity
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The molecular formula of 4-Bromobutyric acid is C4H7BrO2.
The molecular weight of 4-Bromobutyric acid is 167.00 g/mol.
The IUPAC name of 4-Bromobutyric acid is 4-bromobutanoic acid.
The InChI of 4-Bromobutyric acid is InChI=1S/C4H7BrO2/c5-3-1-2-4(6)7/h1-3H2,(H,6,7).
The InChIKey of 4-Bromobutyric acid is GRHQDJDRGZFIPO-UHFFFAOYSA-N.
The canonical SMILES of 4-Bromobutyric acid is C(CC(=O)O)CBr.
The CAS number of 4-Bromobutyric acid is 2623-87-2.
The ChEMBL ID of 4-Bromobutyric acid is CHEMBL1229543.
The XLogP3 value of 4-Bromobutyric acid is 0.8.
The topological polar surface area of 4-Bromobutyric acid is 37.3Ų.