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Primary Amine-Difunctional
2,4-diamino-6-[2-(2-methyl-1-imidazolyl)ethyl]-1,3,5-triazine

2,4-diamino-6-[2-(2-methyl-1-imidazolyl)ethyl]-1,3,5-triazine

Inquiry

Molecular Formula:

C9H13N7

Molecular Weight:

219.25

CAS Number:

38668-46-1

Catalog Number:

38668-46-1

Product Information

Molecular Formula:

C9H13N7

Molecular Weight:

219.25

Description

2,4-diamino-6-[2-(2-methyl-1-imidazolyl)ethyl]-1,3,5-triazine is a useful synthetic compound in biomedicine. It has potential application as a starting point for the development of novel antimalarial drugs. Particularly potent against Plasmodium falciparum strains.

Synonyms

2,4-Diamino-6-(2'-methylimidazol-1-yl)ethyl-S-triazine; 3,5-Triazine-2,4-diamine,6-[2-(2-methyl-1H-imidazol-1-yl)ethyl]-1; 5-triazine-2,4-diamine,6-[2-(2-methyl-1h-imidazol-1-yl)ethyl]-3; 2,4-DIAMINO-6-[2-(2-METHYL-1-IMIDAZOLYL)ETHYL]-1,3,5-TRIAZINE; 6-[2-(2

IUPAC Name

6-[2-(2-methylimidazol-1-yl)ethyl]-1,3,5-triazine-2,4-diamine

Canonical SMILES

CC1=NC=CN1CCC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C9H13N7/c1-6-12-3-5-16(6)4-2-7-13-8(10)15-9(11)14-7/h3,5H,2,4H2,1H3,(H4,10,11,13,14,15)

InChI Key

DRQWQDPSMJHCCM-UHFFFAOYSA-N

Boiling Point

601.6±57.0 °C(Predicted)

Melting Point

253 °C

Purity

97.0%

Density

1.53 g/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

-0.3

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

219.12324344 g/mol

Monoisotopic Mass

219.12324344 g/mol

Topological Polar Surface Area

109Å²

Heavy Atom Count

Formal Charge

Complexity

214

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

Patents

Publication Number	Title	Priority Date
JP-6954485-B1	Sealing resin composition for injection molding	2021-02-17
CN-112724899-A	Underfill adhesive	2020-12-30
WO-2021261064-A1	Liquid compression molding material	2020-06-23
JP-2021152108-A	Resin composition	2020-03-24
KR-20210119324-A	Resin composition	2020-03-24
WO-2021182365-A1	Resin composition and resin sheet	2020-03-09
JP-2021113247-A	Resin composition and resin sheet	2020-01-16
WO-2021145414-A1	Resin sheet	2020-01-16
WO-2021145415-A1	Resin sheet	2020-01-16
WO-2021145416-A1	Resin sheet	2020-01-16

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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