Base information

Cat. No.
CAS No.139042-59-4
Product Name
MDL.

Computed Properties

Property NameProperty Value
Molecular Formula C7H6BrNO
Molecular Weight 200.033
Exact Mass 198.963
XLogP3 2.0467
Mr 42.1315
PSA 29.96
Sequence -
Atom number 16
Bond number 16
Ring number 1
Rotor number 1
Residues number 0
Canonical smiles Brc1ccc(cn1)C(=O)C

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