200,000+ products from a single source!
sales@angenechem.com
158579-80-7 | Benzene, 4-bromo-2-chloro-1-(trifluoromethoxy)-
CAS No: 158579-80-7 Catalog No: AG001QB1 MDL No:MFCD10699114
Product Description
Catalog Number:
AG001QB1
Chemical Name:
Benzene, 4-bromo-2-chloro-1-(trifluoromethoxy)-
CAS Number:
158579-80-7
Molecular Formula:
C7H3BrClF3O
Molecular Weight:
275.4503
MDL Number:
MFCD10699114
IUPAC Name:
4-bromo-2-chloro-1-(trifluoromethoxy)benzene
InChI:
InChI=1S/C7H3BrClF3O/c8-4-1-2-6(5(9)3-4)13-7(10,11)12/h1-3H
InChI Key:
WSENYRJAJFHXQR-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)Cl)OC(F)(F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.901g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.449g/mol
Monoisotopic Mass:
273.901g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.