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18523-22-3 | 2,3'-Dibromoacetophenone
CAS No: 18523-22-3 Catalog No: AG0032XH MDL No:MFCD00082698
Product Description
Catalog Number:
AG0032XH
Chemical Name:
2,3'-Dibromoacetophenone
CAS Number:
18523-22-3
Molecular Formula:
C8H6Br2O
Molecular Weight:
277.9406
MDL Number:
MFCD00082698
IUPAC Name:
2-bromo-1-(3-bromophenyl)ethanone
InChI:
InChI=1S/C8H6Br2O/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4H,5H2
InChI Key:
MZBXSQBQPJWECM-UHFFFAOYSA-N
SMILES:
BrCC(=O)c1cccc(c1)Br
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.876g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.943g/mol
Monoisotopic Mass:
275.879g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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