5-iodo-2-methoxyaniline

5-iodo-2-methoxyaniline

CAS: 77770-09-3

Formula: C7H8INO

SMILES: COC1=C(N)C=C(I)C=C1

IUPAC: 5-iodo-2-methoxyaniline

InChI: InChI=1S/C7H8INO/c1-10-7-3-2-5(8)4-6(7)9/h2-4H,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	1
InChIKey	KCAGMESWEMVFON-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.58
Topological Polar Surface Area	35.25
Polarizability	19.19
Ring Count	1
Rotatable Bond Count	1

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