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Home > Bromides > 1330750-28-1
1330750-28-1 | Benzene, 1-bromo-3-methoxy-5-(trifluoromethoxy)-
CAS No: 1330750-28-1 Catalog No: AG00146N MDL No:MFCD19981548
Product Description
Catalog Number:
AG00146N
Chemical Name:
Benzene, 1-bromo-3-methoxy-5-(trifluoromethoxy)-
CAS Number:
1330750-28-1
Molecular Formula:
C8H6BrF3O2
Molecular Weight:
271.0312
MDL Number:
MFCD19981548
IUPAC Name:
1-bromo-3-methoxy-5-(trifluoromethoxy)benzene
InChI:
InChI=1S/C8H6BrF3O2/c1-13-6-2-5(9)3-7(4-6)14-8(10,11)12/h2-4H,1H3
InChI Key:
XVZXJTCWTLEHQT-UHFFFAOYSA-N
SMILES:
COc1cc(cc(c1)Br)OC(F)(F)F
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.95g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.033g/mol
Monoisotopic Mass:
269.95g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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