chempirical

2-Amino-4'-bromobenzophenone

C13H10BrNOCAS 1140-17-6276.13 g/mol

Open in Covalent MOL file
OBrNH2
Aryl halideKetonePrimary amine

Properties

Molecular formula
C13H10BrNO
Molar mass
276.13 g/mol
Exact mass
274.9946 Da
logP
3.26Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
2

Identifiers

CAS number
1140-17-6
SMILES
C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)Br)N
InChIKey
WIISOMGJWLLMDG-UHFFFAOYSA-N
InChI
InChI=1S/C13H10BrNO/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H,15H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Amino-4'-bromobenzophenone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Amino-4′-chlorobenzophenone2894-51-166 % similar 2′-Amino-4-fluorobenzophenone3800-06-466 % similar 4-Bromobenzophenone90-90-459 % similar 4,4′-Dibromobenzophenone3988-03-257 % similar (2-Amino-5-bromophenyl)(2-fluorophenyl)methanone1479-58-954 % similar 2-(2-Aminobenzoyl)benzoic acid1147-43-950 % similar 2-Bromobenzophenone13047-06-849 % similar Bromfenac sodium91714-93-147 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

6-Bromo-2-methoxy-1-naphthaleneacetonitrile92643-17-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook