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116272-42-5 | Benzene, 4-chloro-1-fluoro-2-iodo-
CAS No: 116272-42-5 Catalog No: AG000C3K MDL No:MFCD00672963
Product Description
Catalog Number:
AG000C3K
Chemical Name:
Benzene, 4-chloro-1-fluoro-2-iodo-
CAS Number:
116272-42-5
Molecular Formula:
C6H3ClFI
Molecular Weight:
256.4439
MDL Number:
MFCD00672963
IUPAC Name:
4-chloro-1-fluoro-2-iodobenzene
InChI:
InChI=1S/C6H3ClFI/c7-4-1-2-5(8)6(9)3-4/h1-3H
InChI Key:
CNJQPBYTHITJAO-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)I)F
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.895g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.443g/mol
Monoisotopic Mass:
255.895g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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