Home Halogens 1-(1-bromoethyl)-4-(trifluoromethyl)benzene

1-(1-bromoethyl)-4-(trifluoromethyl)benzene

CAS No.:
68120-42-3
Catalog Number:
AG01AAGK
Molecular Formula:
C9H8BrF3
Molecular Weight:
253.0590
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Product Description
Catalog Number:
AG01AAGK
Chemical Name:
1-(1-bromoethyl)-4-(trifluoromethyl)benzene
CAS Number:
68120-42-3
Molecular Formula:
C9H8BrF3
Molecular Weight:
253.0590
MDL Number:
MFCD00045103
IUPAC Name:
1-(1-bromoethyl)-4-(trifluoromethyl)benzene
InChI:
InChI=1S/C9H8BrF3/c1-6(10)7-2-4-8(5-3-7)9(11,12)13/h2-6H,1H3
InChI Key:
VWPMBVBOSDEYQU-UHFFFAOYSA-N
SMILES:
CC(c1ccc(cc1)C(F)(F)F)Br
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.976g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.062g/mol
Monoisotopic Mass:
251.976g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties