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375349

2-Amino-4,6-dimethoxypyrimidine

Name: 2-Amino-4,6-dimethoxypyrimidine
Brand: ALDRICH

98%

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About This Item

Empirical Formula (Hill Notation):

C₆H₉N₃O₂

CAS Number:

36315-01-2

Molecular Weight:

155.15

NACRES:

NA.22

PubChem Substance ID:

24863382

UNSPSC Code:

12352100

EC Number:

252-969-6

MDL number:

MFCD00038832

Assay:

98%

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Properties

Quality Level

100

assay

98%

mp

94-96 °C (lit.)

SMILES string

COc1cc(OC)nc(N)n1

InChI

1S/C6H9N3O2/c1-10-4-3-5(11-2)9-6(7)8-4/h3H,1-2H3,(H2,7,8,9)

InChI key

LVFRCHIUUKWBLR-UHFFFAOYSA-N

Description

General description

2-Amino-4,6-dimethoxypyrimidine is identified as degradation product of sulfosulphuron in agricultural soil by ESI LC-MS/MS analysis. It was isolated as metabolite during the biodegradation of bensulphuron-methyl by Penicillium pinophilum by liquid chromatography-mass spectrometry. The FTIR and FT-Raman spectra of 2-amino-4,6-dimethoxypyrimidine has been reported. Hydrogen bonding in the molecules of 2-amino-4,6-dimethoxypyrimidine has been investigated.

Application

2-Amino-4,6-dimethoxypyrimidine is suitable for use in the preparation of cocrystal 2-amino-4,6-dimethoxypyrimidine-anthranilic acid (1/1).

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Hydrogen bonding in 2-amino-4,6-dimethoxypyrimidine, 2-benzylamino-4,6-bis(benzyloxy)pyrimidine and 2-amino-4,6-bis(N-pyrrolidino)pyrimidine: chains of fused rings and a centrosymmetric dimer.

John N Low et al.

Acta crystallographica. Section C, Crystal structure communications, 58(Pt 5), o289-o294 (2002-05-02)

Molecules of 2-amino-4,6-dimethoxypyrimidine, C(6)H(9)N(3)O(2), (I), are linked by two N-H.N hydrogen bonds [H.N 2.23 and 2.50 A, N.N 3.106 (2) and 3.261 (2) A, and N-H.N 171 and 145 degrees ] into a chain of fused rings, where alternate rings

Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 2-amino-4,6-dimethoxypyrimidine.

N Sundaraganesan et al.

Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 65(5), 1186-1196 (2006-07-11)

The FTIR and FT-Raman spectra of 2-amino-4,6-dimethoxypyrimidine (2A46DMP) has been recorded in the region 4000-400 cm(-1) and 3500-100 cm(-1), respectively. The optimized geometry, frequency and intensity of the vibrational bands of 2A46DMP were obtained by the ab initio and DFT

Biodegradation of sulfosulphuron in agricultural soil by Trichoderma sp.

U Yadav et al.

Letters in applied microbiology, 59(5), 479-486 (2014-07-22)

Sulfosulphuron-degrading fungus was isolated by enrichment technique from the sulfosulphuron-contaminated soil of wheat rhizosphere. To assess the biodegradation potential of isolated Trichoderma sp., minimal potato dextrose agar broth with different levels of sulfosulphuron (up to 2 g l(-1) ) was evaluated in

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Global Trade Item Number

SKU	GTIN
375349-5G	04061832913124
375349-25G	04061832913117