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4,6-dimethyl 5-methylpyrimidine-4,6-dicarboxylate

4,6-dimethyl 5-methylpyrimidine-4,6-dicarboxylate

CAS: 2288710-03-0

Formula: C9H10N2O4

SMILES: COC(=O)C1=NC=NC(C(=O)OC)=C1C

IUPAC: 4,6-dimethyl 5-methylpyrimidine-4,6-dicarboxylate

InChI: InChI=1S/C9H10N2O4/c1-5-6(8(12)14-2)10-4-11-7(5)9(13)15-3/h4H,1-3H3

Composition: C (51.43%), H (4.80%), N (13.33%), O (30.45%)

Molar Mass: 210.189

Atom Count: 25

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 210.06405681
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey NKEPFRVDHCZJQX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.07
Topological Polar Surface Area 78.38
Polarizability 19.3
Ring Count 1
Rotatable Bond Count 4

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 2288710-03-0 $55.48-$269.85$55.48$90.79$269.85
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