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1261581-05-8 | Ethanone, 1-(2-amino-4-bromophenyl)-2-bromo-
CAS No: 1261581-05-8 Catalog No: AG000RUN MDL No:
Product Description
Catalog Number:
AG000RUN
Chemical Name:
Ethanone, 1-(2-amino-4-bromophenyl)-2-bromo-
CAS Number:
1261581-05-8
Molecular Formula:
C8H7Br2NO
Molecular Weight:
292.9553
IUPAC Name:
1-(2-amino-4-bromophenyl)-2-bromoethanone
InChI:
InChI=1S/C8H7Br2NO/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4,11H2
InChI Key:
GHFBWHIXMOFAFA-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1ccc(cc1N)Br
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.887g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.958g/mol
Monoisotopic Mass:
290.889g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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