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1214350-42-1

1214350-42-1 | Benzene, 4-bromo-1-(chloromethyl)-2-(trifluoromethyl)-

CAS No: 1214350-42-1 Catalog No: AG0014V1 MDL No:

Product Description

Catalog Number:
AG0014V1
Chemical Name:
Benzene, 4-bromo-1-(chloromethyl)-2-(trifluoromethyl)-
CAS Number:
1214350-42-1
Molecular Formula:
C8H5BrClF3
Molecular Weight:
273.4775
IUPAC Name:
4-bromo-1-(chloromethyl)-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H5BrClF3/c9-6-2-1-5(4-10)7(3-6)8(11,12)13/h1-3H,4H2
InChI Key:
XVCNGLMYDHVHNO-UHFFFAOYSA-N
SMILES:
ClCc1ccc(cc1C(F)(F)F)Br

Properties

Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.922g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.477g/mol
Monoisotopic Mass:
271.922g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  

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