Home Halogens 3-bromo-1,1,1-trifluoro-3-phenylpropan-2-one

3-bromo-1,1,1-trifluoro-3-phenylpropan-2-one

CAS No.:
395-15-3
Catalog Number:
AG01C3L1
Molecular Formula:
C9H6BrF3O
Molecular Weight:
267.0425
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Product Description
Catalog Number:
AG01C3L1
Chemical Name:
3-bromo-1,1,1-trifluoro-3-phenylpropan-2-one
CAS Number:
395-15-3
Molecular Formula:
C9H6BrF3O
Molecular Weight:
267.0425
MDL Number:
MFCD01934515
IUPAC Name:
3-bromo-1,1,1-trifluoro-3-phenylpropan-2-one
InChI:
InChI=1S/C9H6BrF3O/c10-7(8(14)9(11,12)13)6-4-2-1-3-5-6/h1-5,7H
InChI Key:
XWQPKCABAXIHPC-UHFFFAOYSA-N
SMILES:
BrC(C(=O)C(F)(F)F)c1ccccc1
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.955g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.045g/mol
Monoisotopic Mass:
265.955g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties