2-chloro-4-ethoxypyrimidine

2-chloro-4-ethoxypyrimidine

CAS: 83774-09-8

Formula: C6H7ClN2O

SMILES: CCOC1=CC=NC(Cl)=N1

IUPAC: 2-chloro-4-ethoxypyrimidine

InChI: InChI=1S/C6H7ClN2O/c1-2-10-5-3-4-8-6(7)9-5/h3-4H,2H2,1H3

Composition: C (45.44%), H (4.45%), Cl (22.35%), N (17.66%), O (10.09%)

Molar Mass: 158.59

Atom Count: 17

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	158.0246906
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	PXTBPZQWBZWDFS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.75
Topological Polar Surface Area	35.01
Polarizability	14.96
Ring Count	1
Rotatable Bond Count	2

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