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207226-31-1

207226-31-1 | Benzene, 1,3-dibromo-5-(trifluoromethoxy)-

CAS No: 207226-31-1 Catalog No: AG002IW7 MDL No:MFCD00075280

Product Description

Catalog Number:
AG002IW7
Chemical Name:
Benzene, 1,3-dibromo-5-(trifluoromethoxy)-
CAS Number:
207226-31-1
Molecular Formula:
C7H3Br2F3O
Molecular Weight:
319.9013
MDL Number:
MFCD00075280
IUPAC Name:
1,3-dibromo-5-(trifluoromethoxy)benzene
InChI:
InChI=1S/C7H3Br2F3O/c8-4-1-5(9)3-6(2-4)13-7(10,11)12/h1-3H
InChI Key:
UKHOUWWEEAOCTI-UHFFFAOYSA-N
SMILES:
FC(Oc1cc(Br)cc(c1)Br)(F)F

Properties

Complexity:
164  
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  

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