3-(chloromethyl)-5-ethyl-1,2,4-oxadiazole

3-(chloromethyl)-5-ethyl-1,2,4-oxadiazole

CAS: 83227-01-4

Formula: C5H7ClN2O

SMILES: CCC1=NC(CCl)=NO1

IUPAC: 3-(chloromethyl)-5-ethyl-1,2,4-oxadiazole

InChI: InChI=1S/C5H7ClN2O/c1-2-5-7-4(3-6)8-9-5/h2-3H2,1H3

Composition: C (40.97%), H (4.81%), Cl (24.19%), N (19.11%), O (10.92%)

Molar Mass: 146.57

Atom Count: 16

Heavy Atom Count: 9

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	146.0246906
Formal Charge	0
FSP3	0.6
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	PGYXLMWYFOXGGN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.12
Topological Polar Surface Area	38.92
Polarizability	12.84
Ring Count	1
Rotatable Bond Count	2

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