Home Halogens 2-chloro-6-fluoro-3-iodobenzoic acid

2-chloro-6-fluoro-3-iodobenzoic acid

CAS No.:
1269448-25-0
Catalog Number:
AG01BVDZ
Molecular Formula:
C7H3ClFIO2
Molecular Weight:
300.4534
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Product Description
Catalog Number:
AG01BVDZ
Chemical Name:
2-chloro-6-fluoro-3-iodobenzoic acid
CAS Number:
1269448-25-0
Molecular Formula:
C7H3ClFIO2
Molecular Weight:
300.4534
MDL Number:
MFCD18452151
IUPAC Name:
2-chloro-6-fluoro-3-iodobenzoic acid
InChI:
InChI=1S/C7H3ClFIO2/c8-6-4(10)2-1-3(9)5(6)7(11)12/h1-2H,(H,11,12)
InChI Key:
XTZCQKSICWVALD-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(F)ccc(c1Cl)I
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.885g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
300.452g/mol
Monoisotopic Mass:
299.885g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties