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15328-03-7 | 5-(Chloromethyl)-3-(pyridin-3-yl)-1,2,4-oxadiazole
CAS No: 15328-03-7 Catalog No: AG007Y7X MDL No:MFCD00264506
Product Description
Catalog Number:
AG007Y7X
Chemical Name:
5-(Chloromethyl)-3-(pyridin-3-yl)-1,2,4-oxadiazole
CAS Number:
15328-03-7
Molecular Formula:
C8H6ClN3O
Molecular Weight:
195.6057
MDL Number:
MFCD00264506
IUPAC Name:
5-(chloromethyl)-3-pyridin-3-yl-1,2,4-oxadiazole
InChI:
InChI=1S/C8H6ClN3O/c9-4-7-11-8(12-13-7)6-2-1-3-10-5-6/h1-3,5H,4H2
InChI Key:
RGRRKYQLLSVYGV-UHFFFAOYSA-N
SMILES:
ClCc1onc(n1)c1cccnc1
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.02g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.606g/mol
Monoisotopic Mass:
195.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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