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3-chloro-5-methyl-1,2,4-oxadiazole

3-chloro-5-methyl-1,2,4-oxadiazole

CAS: 1359822-66-4

Formula: C3H3ClN2O

SMILES: CC1=NC(Cl)=NO1

IUPAC: 3-chloro-5-methyl-1,2,4-oxadiazole

InChI: InChI=1S/C3H3ClN2O/c1-2-5-3(4)6-7-2/h1H3

Composition: C (30.40%), H (2.55%), Cl (29.91%), N (23.64%), O (13.50%)

Molar Mass: 118.52

Atom Count: 10

Heavy Atom Count: 7

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 117.9933904
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey UBCHWZCUZUNNHK-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 26.61
Topological Polar Surface Area 38.92
Polarizability 9.42
Ring Count 1
Rotatable Bond Count 0

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