Home Halogens 2,4-dibromo-1-(trifluoromethoxy)benzene

2,4-dibromo-1-(trifluoromethoxy)benzene

CAS No.:
1840-97-7
Catalog Number:
AG00ASLE
Molecular Formula:
C7H3Br2F3O
Molecular Weight:
319.9013
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Product Description
Catalog Number:
AG00ASLE
Chemical Name:
2,4-dibromo-1-(trifluoromethoxy)benzene
CAS Number:
1840-97-7
Molecular Formula:
C7H3Br2F3O
Molecular Weight:
319.9013
MDL Number:
MFCD20233323
IUPAC Name:
2,4-dibromo-1-(trifluoromethoxy)benzene
InChI:
InChI=1S/C7H3Br2F3O/c8-4-1-2-6(5(9)3-4)13-7(10,11)12/h1-3H
InChI Key:
KKHVOILWGQCNJL-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Br)OC(F)(F)F
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.848g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.903g/mol
Monoisotopic Mass:
317.85g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties