Chemical ID: 5190448

c1cc(oc1)c2nc(on2)CCl
Chemical ID:
5190448
Name [?]:
5-(chloromethyl)-3-(2-furyl)-1,2,4-oxadiazole
SMILES [?]:
c1cc(oc1)c2nc(on2)CCl
InChi [?]:
InChI=1/C7H5ClN2O2/c8-4-6-9-7(10-12-6)5-2-1-3-11-5/h1-3H,4H2
InChi Info:
AuxInfo=1/0/N:1,2,5,11,3,8,6,12,7,10,4,9/rA:12nCCCOCCNCONCCl/rB:s1;d2;s3;d1s4;s3;s6;d7;s8;d6s9;s8;s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H5ClN2O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.1973
Area:345.007
Solvation:-2.42788
Coulombic:-19.2145
Bond Count [?]
All:13
Single:9
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:184.58
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.32
LogP (Chemaxon):1.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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