4,4'-Ethylenedianiline

Inquiry

Molecular Formula:

C14H16N2

Molecular Weight:

212.29

CAS Number:

621-95-4

Catalog Number:

621-95-4

Product Information

Molecular Formula:

C14H16N2

Molecular Weight:

212.29

Description

4,4'-Ethylenedianiline (CAS# 621-95-4) is used as a reagent in the synthesis of new substituted Bis[2-Imino-3(substituted)-4-phenyl-3H-thiazole] derivativatives and in evaluation of their antibacterial activity.

Synonyms

4-[2-(4-aminophenyl)ethyl]aniline

IUPAC Name

4-[2-(4-aminophenyl)ethyl]aniline

Canonical SMILES

C1=CC(=CC=C1CCC2=CC=C(C=C2)N)N

InChI

InChI=1S/C14H16N2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h3-10H,1-2,15-16H2

InChI Key

UHNUHZHQLCGZDA-UHFFFAOYSA-N

Boiling Point

342.14 °C (rough estimate)

Melting Point

133-137 °C (lit.)

Purity

> 97.0 % (GC) (T)

Density

1.132 g/cm³

Solubility

22 [ug/mL] (The mean of the results at pH 7.4)

Appearance

White to gray to brown powder to crystal

Refractive Index

1.4400 (estimate)

LogP

3.79860

Safety Information

Hazards

H302+H312+H332:
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H341:
Suspected of causing genetic defects.

Precautionary Statement

P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501

Signal Word

Warning

Computed Properties

XLogP3

1.9

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

212.131348519 g/mol

Monoisotopic Mass

212.131348519 g/mol

Topological Polar Surface Area

52Å²

Heavy Atom Count

Formal Charge

Complexity

167

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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4,4'-Ethylenedianiline

Product Information

Safety Information

Computed Properties

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