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407-14-7 | 1-Bromo-4-(Trifluoromethoxy)Benzene
CAS No: 407-14-7 Catalog No: AG0032PT MDL No:MFCD00040834
Product Description
Catalog Number:
AG0032PT
Chemical Name:
1-Bromo-4-(Trifluoromethoxy)Benzene
CAS Number:
407-14-7
Molecular Formula:
C7H4BrF3O
Molecular Weight:
241.0053
MDL Number:
MFCD00040834
IUPAC Name:
1-bromo-4-(trifluoromethoxy)benzene
InChI:
InChI=1S/C7H4BrF3O/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H
InChI Key:
SEAOBYFQWJFORM-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(cc1)Br)(F)F
EC Number:
206-979-2
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.94g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.007g/mol
Monoisotopic Mass:
239.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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