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1000575-02-9 | 2-Bromo-4-difluoromethoxyiodobenzene
CAS No: 1000575-02-9 Catalog No: AG01FDA9 MDL No:MFCD09878210
Product Description
Catalog Number:
AG01FDA9
Chemical Name:
2-Bromo-4-difluoromethoxyiodobenzene
CAS Number:
1000575-02-9
Molecular Formula:
C7H4BrF2IO
Molecular Weight:
348.9113
MDL Number:
MFCD09878210
IUPAC Name:
2-bromo-4-(difluoromethoxy)-1-iodobenzene
InChI:
InChI=1S/C7H4BrF2IO/c8-5-3-4(12-7(9)10)1-2-6(5)11/h1-3,7H
InChI Key:
XFABSMJJAYAEDX-UHFFFAOYSA-N
SMILES:
FC(Oc1ccc(c(c1)Br)I)F
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.846g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
348.913g/mol
Monoisotopic Mass:
347.846g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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