5-amino-4-iodo-2-methylphenol

5-amino-4-iodo-2-methylphenol

CAS: 388616-53-3

Formula: C7H8INO

SMILES: CC1=C(O)C=C(N)C(I)=C1

IUPAC: 5-amino-4-iodo-2-methylphenol

InChI: InChI=1S/C7H8INO/c1-4-2-5(8)6(9)3-7(4)10/h2-3,10H,9H2,1H3

Composition: C (33.76%), H (3.24%), I (50.96%), N (5.62%), O (6.42%)

Molar Mass: 249.051

Atom Count: 18

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	248.96506
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	WNJQYXWJLWCWTA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.14
Topological Polar Surface Area	46.25
Polarizability	19.06
Ring Count	1
Rotatable Bond Count	0

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