Home Halogens 1-[(E)-2-bromoethenyl]-3-(trifluoromethyl)benzene, E

1-[(E)-2-bromoethenyl]-3-(trifluoromethyl)benzene, E

CAS No.:
114092-59-0
Catalog Number:
AG01DYFP
Molecular Formula:
C9H6BrF3
Molecular Weight:
251.0431
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Product Description
Catalog Number:
AG01DYFP
Chemical Name:
1-[(E)-2-bromoethenyl]-3-(trifluoromethyl)benzene, E
CAS Number:
114092-59-0
Molecular Formula:
C9H6BrF3
Molecular Weight:
251.0431
MDL Number:
MFCD18250712
IUPAC Name:
1-[(E)-2-bromoethenyl]-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C9H6BrF3/c10-5-4-7-2-1-3-8(6-7)9(11,12)13/h1-6H/b5-4+
InChI Key:
SORYLDUWQMEDRE-SNAWJCMRSA-N
SMILES:
Br/C=C/c1cccc(c1)C(F)(F)F
Properties
Complexity:
186  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
249.96g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.046g/mol
Monoisotopic Mass:
249.96g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties