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Sigma-Aldrich

9-Methyladenine

97%

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About This Item

Empirical Formula (Hill Notation):
C6H7N5
CAS Number:
Molecular Weight:
149.15
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

mp

300-305 °C (lit.)

SMILES string

Cn1cnc2c(N)ncnc12

InChI

1S/C6H7N5/c1-11-3-10-4-5(7)8-2-9-6(4)11/h2-3H,1H3,(H2,7,8,9)

InChI key

WRXCXOUDSPTXNX-UHFFFAOYSA-N

Gene Information

General description

9-Methyladenine is a derivative of adenine. It belongs to the monoclinic crystal system and P21/c space group.

Application

9-Methyladenine may be used in the preparation of N6-benzoyl-9-methyladenine.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Bruno Longato et al.
Inorganic chemistry, 45(4), 1805-1814 (2006-02-14)
The hydroxo complex cis-[L2Pt(mu-OH)]2(NO3)2, (L = PMePh2, 1a), in CH3CN solution, deprotonates the NH2 group of 9-methyladenine (9-MeAd) to give the cyclic trinuclear species cis-[L2Pt[9-MeAd(-H)]]3(NO3)3, (L = PMePh2, 2a), in which the nucleobase binds the metal centers through the N(1)
The neutron crystal structure of 9-methyladenine at 126 K.
McMullan RK, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials, 36(6), 1424-1430 (1980)
Gydo C P van Zundert et al.
Chemphyschem : a European journal of chemical physics and physical chemistry, 12(10), 1921-1927 (2011-05-28)
IR spectroscopy is employed to study isolated adenine and its derivative 9-methyladenine in both their neutral and protonated forms. The IR spectra of neutral adenine and 9-methyladenine are measured in a molecular beam expansion via IR-UV ion-dip spectroscopy in the
Chris T Middleton et al.
The journal of physical chemistry. A, 111(42), 10460-10467 (2007-10-04)
Vibrational cooling by 9-methyladenine was studied in a series of solvents by femtosecond transient absorption spectroscopy. Signals at UV and near-UV probe wavelengths were assigned to hot ground state population created by ultrafast internal conversion following electronic excitation by a
Excited state spectroscopy and dynamics of isolated adenine and 9-methyladenine.
Luhrs DC, et al.
Physical Chemistry Chemical Physics, 3(10), 1827-1831 (2001)

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