CAS 201802-15-5 4-Iodo-4',4''-dimethoxytriphenylamine

NAVIGATION

4-Iodo-4',4''-dimethoxytriphenylamine

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Catalog Number

ACM201802155

CAS Number

201802-15-5

Product Name

4-Iodo-4',4''-dimethoxytriphenylamine

Structure

Category

Small Molecule Semiconductor Building Blocks; Electroluminescence Materials; Semiconductor Blocks

Synonyms

4-Iodo-N,N-bis(4-methoxyphenyl)aniline

IUPAC Name

N-(4-iodophenyl)-4-methoxy-N-(4-methoxyphenyl)aniline

Molecular Weight

431.27

Molecular Formula

C20H18INO2

Canonical SMILES

COC1=CC=C(C=C1)N(C2=CC=C(C=C2)OC)C3=CC=C(C=C3)I

InChI

InChI=1S/C20H18INO2/c1-23-19-11-7-17(8-12-19)22(16-5-3-15(21)4-6-16)18-9-13-20(24-2)14-10-18/h3-14H,1-2H3

InChI Key

VGQDQJMYUYSINZ-UHFFFAOYSA-N

Melting Point

111 °C

Purity

>98.0%(HPLC)(N)

Appearance

White to Light yellow to Light orange powder to crystal

Complexity

333

Covalently-Bonded Unit Count

Exact Mass

431.03823g/mol

Formal Charge

Hazard Statements

H315 : Causes skin irritation.H319 : Causes serious eye irritation.

Heavy Atom Count

Monoisotopic Mass

431.03823g/mol

Precautionary Statements

P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.

Rotatable Bond Count

Signal Word

Warning

XLogP3

5.8

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