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913264-42-3,MFCD11226634
Catalog No.:AA00GVC9
913264-42-3 | tert-butyl 4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxylate
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1g
95%
2 weeks  
$158.00
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  • Technical Information
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Technical Information
Catalog Number:
AA00GVC9
Chemical Name:
tert-butyl 4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxylate
CAS Number:
913264-42-3
Molecular Formula:
C15H25N3O3
Molecular Weight:
295.3773
MDL Number:
MFCD11226634
IUPAC Name:
tert-butyl 4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxylate
InChI:
InChI=1S/C15H25N3O3/c1-10(2)12-16-13(21-17-12)11-6-8-18(9-7-11)14(19)20-15(3,4)5/h10-11H,6-9H2,1-5H3
InChI Key:
QIHZUQZZJHBESB-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)c1onc(n1)C(C)C)OC(C)(C)C
Properties
Computed Properties
 
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.19g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.383g/mol
Monoisotopic Mass:
295.19g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

Synonyms
 
913264-42-3 
tert-butyl 4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxylate 
ZINC30715007 
AKOS005255810 
RP06771 
AJ-84166 
EN002136 
DB-078984 
TR-055203 
FT-0703965 
Y4669 
X-4137 
4-(3-Isopropyl-[1,2,4]oxadiazol-5-yl)piperidine-1-carboxylic acid tert-butyl ester 
J-513394 
I14-100383 
tert-butyl 4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidin-1-carboxylate 
4-(3-Isopropyl-[1,2,4]oxadiazol-5-yl)piperidine-1-carboxylic acid tert-butyl ester, AldrichCPR 
C15H25N3O3 
tert-Butyl4-(3-isopropyl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxylate 
tert-Butyl 4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxylate 
SCHEMBL12069832 
CTK7G2799 
DTXSID80653376 
QIHZUQZZJHBESB-UHFFFAOYSA-N 
BBL101066 
STL554860 
Literature
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