N2,N2-Diallylmelamine

Inquiry

Molecular Formula:

C9H14N6

Molecular Weight:

206.25

CAS Number:

91-77-0

Catalog Number:

91-77-0

Product Information

Molecular Formula:

C9H14N6

Molecular Weight:

206.25

Description

N2, N2-Diallylmelamine is an intriguing chemical compound extensively employed in the biomedical field that has attracted significant attention due to its remarkable antitumor properties. With promising outcomes observed in impeding the proliferation of specific malignant cells, this compound exhibits great potential in treating diverse forms of cancer.

Synonyms

5-triazine-2,4,6-triamine,n,n-di-2-propenyl-3; 2,4-DIAMINO-6-DIALLYLAMINO-1,3,5-TRIAZINE; N2,N2-DIALLYLMELAMINE; N,N-DIALLYLMELAMINE; diallyl(4,6-diamino-1,3,5-triazin-2-yl)amine; 4-(Diallylamino)-2,6-diamino-1,3,5-triazine; 6-(Diallylamino)-1,3,5-triazine-2,4

IUPAC Name

2-N,2-N-bis(prop-2-enyl)-1,3,5-triazine-2,4,6-triamine

Canonical SMILES

C=CCN(CC=C)C1=NC(=NC(=N1)N)N

InChI

InChI=1S/C9H14N6/c1-3-5-15(6-4-2)9-13-7(10)12-8(11)14-9/h3-4H,1-2,5-6H2,(H4,10,11,12,13,14)

InChI Key

ROHTVIURAJBDES-UHFFFAOYSA-N

Boiling Point

438.1ºC at 760 mmHg

Melting Point

140-142ºC

Purity

PRACTICAL

Density

1.228g/cm3

Appearance

White to Almost white powder to crystal

Safety Information

Hazards

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

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

206.12799447 g/mol

Monoisotopic Mass

206.12799447 g/mol

Topological Polar Surface Area

94Å²

Heavy Atom Count

Formal Charge

Complexity

199

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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N2,N2-Diallylmelamine

Product Information

Safety Information

Computed Properties

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