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870704-15-7 | 1-Bromo-2-fluoro-5-iodo-4-methylbenzene
CAS No: 870704-15-7 Catalog No: AG003KYW MDL No:MFCD06200719
Product Description
Catalog Number:
AG003KYW
Chemical Name:
1-Bromo-2-fluoro-5-iodo-4-methylbenzene
CAS Number:
870704-15-7
Molecular Formula:
C7H5BrFI
Molecular Weight:
314.9215
MDL Number:
MFCD06200719
IUPAC Name:
1-bromo-2-fluoro-5-iodo-4-methylbenzene
InChI:
InChI=1S/C7H5BrFI/c1-4-2-6(9)5(8)3-7(4)10/h2-3H,1H3
InChI Key:
ACDTXEFSNCPJED-UHFFFAOYSA-N
SMILES:
Ic1cc(Br)c(cc1C)F
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.86g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.924g/mol
Monoisotopic Mass:
313.86g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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