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5-amino-2-iodobenzoic acid hydrochloride

5-amino-2-iodobenzoic acid hydrochloride

CAS: 2065250-46-4

Formula: C7H7ClINO2

SMILES: Cl.NC1=CC(C(O)=O)=C(I)C=C1

IUPAC: 5-amino-2-iodobenzoic acid hydrochloride

InChI: InChI=1S/C7H6INO2.ClH/c8-6-2-1-4(9)3-5(6)7(10)11;/h1-3H,9H2,(H,10,11);1H

Composition: C (28.07%), H (2.36%), Cl (11.84%), I (42.37%), N (4.68%), O (10.68%)

Molar Mass: 299.49

Atom Count: 19

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 298.921
Formal Charge 0
FSP3 0
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey YAOAVWSUXQYLEJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.38
Topological Polar Surface Area 63.32
Polarizability 19.15
Ring Count 1
Rotatable Bond Count 1

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