5-Iodo-2-methoxyaniline

C₇H₈INOCAS 77770-09-3249.05 g/mol

Open in Covalent MOL file

Aryl halide Ether Primary amine

Properties

Molecular formula: C₇H₈INO
Molar mass: 249.05 g/mol
Exact mass: 248.9651 Da
logP: 1.88Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

77770-09-3

SMILES

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

InChIKey

KCAGMESWEMVFON-UHFFFAOYSA-N

InChI

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

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 5-Iodo-2-methoxyaniline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Iodo-1,2-dimethoxybenzene5460-32-267 % similar 2,5-Dimethoxyaniline102-56-759 % similar 2,4-Diaminoanisole615-05-459 % similar para-Cresidine120-71-857 % similar 4-Iodobenzene-1,2-diamine21304-38-156 % similar 5-Iodo-2-methylaniline83863-33-655 % similar 5-Fluoro-2-methoxyaniline1978-39-855 % similar 5-Bromo-2-methoxyaniline6358-77-655 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Iodo-4-methoxyphenylamine191348-14-8 3-Iodo-4-methoxybenzenamine74587-12-5

Elsewhere

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