Home Halogens 1,2,4-Oxadiazole, 3-(chloromethyl)-5-cyclohexyl-

1,2,4-Oxadiazole, 3-(chloromethyl)-5-cyclohexyl-

CAS No.:
189130-88-9
Catalog Number:
AG002HXM
Molecular Formula:
C9H13ClN2O
Molecular Weight:
200.6653
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Product Description
Catalog Number:
AG002HXM
Chemical Name:
1,2,4-Oxadiazole, 3-(chloromethyl)-5-cyclohexyl-
CAS Number:
189130-88-9
Molecular Formula:
C9H13ClN2O
Molecular Weight:
200.6653
MDL Number:
MFCD10690696
IUPAC Name:
3-(chloromethyl)-5-cyclohexyl-1,2,4-oxadiazole
InChI:
InChI=1S/C9H13ClN2O/c10-6-8-11-9(13-12-8)7-4-2-1-3-5-7/h7H,1-6H2
InChI Key:
NIMUCISAHGYZIW-UHFFFAOYSA-N
SMILES:
ClCc1noc(n1)C1CCCCC1
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.072g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.666g/mol
Monoisotopic Mass:
200.072g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties