Home Halogens methyl 4,5-dichloro-2-iodobenzoate

methyl 4,5-dichloro-2-iodobenzoate

CAS No.:
1538516-21-0
Catalog Number:
AG01BHIO
Molecular Formula:
C8H5Cl2IO2
Molecular Weight:
330.9346
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Product Description
Catalog Number:
AG01BHIO
Chemical Name:
methyl 4,5-dichloro-2-iodobenzoate
CAS Number:
1538516-21-0
Molecular Formula:
C8H5Cl2IO2
Molecular Weight:
330.9346
MDL Number:
MFCD24108549
IUPAC Name:
methyl 4,5-dichloro-2-iodobenzoate
InChI:
InChI=1S/C8H5Cl2IO2/c1-13-8(12)4-2-5(9)6(10)3-7(4)11/h2-3H,1H3
InChI Key:
SFNSUNDQIIPEGP-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Cl)c(cc1I)Cl
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.871g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.93g/mol
Monoisotopic Mass:
329.871g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties