ethyl 2-(pyrimidin-4-yl)acetate

ethyl 2-(pyrimidin-4-yl)acetate

CAS: 1240606-58-9

Formula: C8H10N2O2

SMILES: CCOC(=O)CC1=NC=NC=C1

IUPAC: ethyl 2-(pyrimidin-4-yl)acetate

InChI: InChI=1S/C8H10N2O2/c1-2-12-8(11)5-7-3-4-9-6-10-7/h3-4,6H,2,5H2,1H3

Composition: C (57.82%), H (6.07%), N (16.86%), O (19.26%)

Molar Mass: 166.18

Atom Count: 22

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	166.07422757
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	MYZVJNQHRQQRRV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.18
Topological Polar Surface Area	52.08
Polarizability	16.7
Ring Count	1
Rotatable Bond Count	4

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