Home Halogens 3-bromo-4-(4-chloro-2-fluorophenyl)butan-2-one

3-bromo-4-(4-chloro-2-fluorophenyl)butan-2-one

CAS No.:
1250030-38-6
Catalog Number:
AG01BENP
Molecular Formula:
C10H9BrClFO
Molecular Weight:
279.5333
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Product Description
Catalog Number:
AG01BENP
Chemical Name:
3-bromo-4-(4-chloro-2-fluorophenyl)butan-2-one
CAS Number:
1250030-38-6
Molecular Formula:
C10H9BrClFO
Molecular Weight:
279.5333
MDL Number:
MFCD16748562
IUPAC Name:
3-bromo-4-(4-chloro-2-fluorophenyl)butan-2-one
InChI:
InChI=1S/C10H9BrClFO/c1-6(14)9(11)4-7-2-3-8(12)5-10(7)13/h2-3,5,9H,4H2,1H3
InChI Key:
YEJTTYZBANPNIU-UHFFFAOYSA-N
SMILES:
CC(=O)C(Cc1ccc(cc1F)Cl)Br
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.951g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.533g/mol
Monoisotopic Mass:
277.951g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties