MLS000545091

CAT: 0607-BA7928-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0607-BA7928-5Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

322666-76-2

Form

A solid

Molecular Formula

C14H15ClN2O

Molecular Weight

262.73

Shipping Conditions

Blue ice

Storage Conditions

-20°C.

Chemical Information

2-(4-Chlorophenyl)-5-cyclohexyl-1,3,4-oxadiazole

CAS Number	322666-76-2
PubChem CID	767103
IUPAC Name	2-(4-chlorophenyl)-5-cyclohexyl-1,3,4-oxadiazole
Molecular Formula	C14H15ClN2O
Molecular Weight	262.73
XLogP	4.2
Topological Polar Surface Area	38.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	18
Formal Charge	0
Complexity	263

SMILES

C1CCC(CC1)C2=NN=C(O2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H15ClN2O/c15-12-8-6-11(7-9-12)14-17-16-13(18-14)10-4-2-1-3-5-10/h6-10H,1-5H2

InChIKey

ASRSXDRAEGLYDZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 322666-76-2

CID: 767103

Formula: C14H15ClN2O

MW: 262.73

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	262.73
XLogP3	4.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	262.0872908
Monoisotopic Mass	262.0872908
Topological Polar Surface Area	38.9 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	263
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
T24488-01	MLS000545091