Home Other Building Blocks 4-FLUORO-3-IODO-5-NITROBENZOIC ACID

4-FLUORO-3-IODO-5-NITROBENZOIC ACID

CAS No.:
1531675-35-0
Catalog Number:
AG01EL9H
Molecular Formula:
C7H3FINO4
Molecular Weight:
311.0059
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Product Description
Catalog Number:
AG01EL9H
Chemical Name:
4-FLUORO-3-IODO-5-NITROBENZOIC ACID
CAS Number:
1531675-35-0
Molecular Formula:
C7H3FINO4
Molecular Weight:
311.0059
IUPAC Name:
4-fluoro-3-iodo-5-nitrobenzoic acid
InChI:
InChI=1S/C7H3FINO4/c8-6-4(9)1-3(7(11)12)2-5(6)10(13)14/h1-2H,(H,11,12)
InChI Key:
NZZMXGDGWXYODD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(cc(c1F)I)C(=O)O
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.909g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
311.007g/mol
Monoisotopic Mass:
310.909g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties