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Home Other Building Blocks 5-Methylpyrimidine

5-Methylpyrimidine

CAS No.:
2036-41-1
Catalog Number:
AG002915
Molecular Formula:
C5H6N2
Molecular Weight:
94.1145
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$62
- +
5g
98%
In Stock USA
United States
$188
- +
10g
98%
In Stock USA
United States
$338
- +
25g
98%
In Stock USA
United States
$669
- +
Product Description
Catalog Number:
AG002915
Chemical Name:
5-Methylpyrimidine
CAS Number:
2036-41-1
Molecular Formula:
C5H6N2
Molecular Weight:
94.1145
MDL Number:
MFCD00047386
IUPAC Name:
5-methylpyrimidine
InChI:
InChI=1S/C5H6N2/c1-5-2-6-4-7-3-5/h2-4H,1H3
InChI Key:
TWGNOYAGHYUFFR-UHFFFAOYSA-N
SMILES:
Cc1cncnc1
EC Number:
218-006-9
Properties
Complexity:
48  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
94.053g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
94.117g/mol
Monoisotopic Mass:
94.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
S0 and S1 state structure, methyl torsional barrier heights, and fast intersystem crossing dynamics of 5-methyl-2-hydroxypyrimidine. The journal of physical chemistry. A 20111124
Development of miracle medicines from sialic acids. Proceedings of the Japan Academy. Series B, Physical and biological sciences 20110610
On the role of methyl torsional modes in the intersystem crossing dynamics of isolated molecules. The journal of physical chemistry. A 20071213
Antiviral and cytostatic evaluation of the novel 6-acyclic chain substituted thymine derivatives. Antiviral chemistry & chemotherapy 20050101
Properties