Home Other Building Blocks ethyl 3-fluoro-5-iodobenzoate

ethyl 3-fluoro-5-iodobenzoate

CAS No.:
850864-48-1
Catalog Number:
AG01BI4O
Molecular Formula:
C9H8FIO2
Molecular Weight:
294.0615
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Product Description
Catalog Number:
AG01BI4O
Chemical Name:
ethyl 3-fluoro-5-iodobenzoate
CAS Number:
850864-48-1
Molecular Formula:
C9H8FIO2
Molecular Weight:
294.0615
MDL Number:
MFCD08447298
IUPAC Name:
ethyl 3-fluoro-5-iodobenzoate
InChI:
InChI=1S/C9H8FIO2/c1-2-13-9(12)6-3-7(10)5-8(11)4-6/h3-5H,2H2,1H3
InChI Key:
UXBIJQIHOKZIBY-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(F)cc(c1)I
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.955g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.064g/mol
Monoisotopic Mass:
293.955g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties