Molecular Identity
Bromoacetic Acid
2-bromoacetic acid
PubChem CID: 6227
2D Structure
Properties
C2H3BrO2
Molecular Formula
138.95
Molecular Weight
g/mol
137.9316
Exact Mass
Da
0.4
XLogP
Drug-like (Lipinski: < 5)
37.3
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
2
H-Bond Acceptors
42
Complexity
SMILES
Canonical SMILES
SMILES: C(C(=O)O)BrIsomeric SMILES
SMILES: C(C(=O)O)BrSynonyms(20)
BROMOACETIC ACID2-Bromoacetic acid79-08-3Acetic acid, bromo-Monobromoacetic acidBromoethanoic acidTo NTUBromoacetate ionAcide bromacetique2-Bromoacetyl Group2-bromoethanoic acidMonobromessigsaeureKyselina bromoctovaalpha-Bromoacetic acidBromo-acetic acid
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Bromoacetic Acid
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