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101335-11-9 | Benzene, 2-chloro-4-fluoro-1-iodo-
CAS No: 101335-11-9 Catalog No: AG00049E MDL No:MFCD00051774
Product Description
Catalog Number:
AG00049E
Chemical Name:
Benzene, 2-chloro-4-fluoro-1-iodo-
CAS Number:
101335-11-9
Molecular Formula:
C6H3ClFI
Molecular Weight:
256.4439
MDL Number:
MFCD00051774
IUPAC Name:
2-chloro-4-fluoro-1-iodobenzene
InChI:
InChI=1S/C6H3ClFI/c7-5-3-4(8)1-2-6(5)9/h1-3H
InChI Key:
POTCKVPDYXEGSV-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Cl)I
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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