C1=C(C(=CC(=C1I)F)N)C(=O)O
CAS: 231278-08-3
Name: 2-amino-4-fluoro-5-iodobenzoic acid
SMILES: C1=C(C(=CC(=C1I)F)N)C(=O)O

Molecular Processing

Molecular formula
C7H5FINO2
Molecular weight
281.02
Exact mass
280.9349
XLogP
1.71
TPSA
63.32
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
50.49

Supplementary Information

InChIKey: WQFNPHMSIVIAMP-UHFFFAOYSA-N
Synonyms
2-amino-4-fluoro-5-iodobenzoic acid231278-08-32-Amino-4-fluoro-5-iodo-benzoic AcidMFCD28154604SCHEMBL3321387WQFNPHMSIVIAMP-UHFFFAOYSA-N2-amino-4-fluoro-5-iodobenzoicacidAC5683AKOS027427576SB82121CS-12360DA-28955SY047573CS-0371735F759369
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Involved in 23 reactions→

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