Home Halogens 2-(2-Chloro-5-iodine benzyl)-5-(3-(6-fluoro-pyridyl)) thiophene

2-(2-Chloro-5-iodine benzyl)-5-(3-(6-fluoro-pyridyl)) thiophene

CAS No.:
1131770-46-1
Catalog Number:
AG0082CC
Molecular Formula:
C16H10ClFINS
Molecular Weight:
429.6782
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Product Description
Catalog Number:
AG0082CC
Chemical Name:
2-(2-Chloro-5-iodine benzyl)-5-(3-(6-fluoro-pyridyl)) thiophene
CAS Number:
1131770-46-1
Molecular Formula:
C16H10ClFINS
Molecular Weight:
429.6782
MDL Number:
MFCD12405595
IUPAC Name:
5-[5-[(2-chloro-5-iodophenyl)methyl]thiophen-2-yl]-2-fluoropyridine
InChI:
InChI=1S/C16H10ClFINS/c17-14-4-2-12(19)7-11(14)8-13-3-5-15(21-13)10-1-6-16(18)20-9-10/h1-7,9H,8H2
InChI Key:
QMWRODWMUFMTIX-UHFFFAOYSA-N
SMILES:
Fc1ccc(cn1)c1ccc(s1)Cc1cc(I)ccc1Cl
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
428.925g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
429.676g/mol
Monoisotopic Mass:
428.925g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9  
Properties