2,5-dimethyl pyrazine-2,5-dicarboxylate

2,5-dimethyl pyrazine-2,5-dicarboxylate

CAS: 13051-89-3

Formula: C8H8N2O4

SMILES: COC(=O)C1=CN=C(C=N1)C(=O)OC

IUPAC: 2,5-dimethyl pyrazine-2,5-dicarboxylate

InChI: InChI=1S/C8H8N2O4/c1-13-7(11)5-3-10-6(4-9-5)8(12)14-2/h3-4H,1-2H3

Composition: C (48.98%), H (4.11%), N (14.28%), O (32.62%)

Molar Mass: 196.162

Atom Count: 22

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.048406746
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	DQGTTXDDKDMEHB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.05
Topological Polar Surface Area	78.38
Polarizability	17.56
Ring Count	1
Rotatable Bond Count	4

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