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114724-47-9

114724-47-9 | 1,2,4-Oxadiazole, 3-methyl-5-(1-methyl-3-pyrrolidinyl)-

CAS No: 114724-47-9 Catalog No: AG000F4E MDL No:

Product Description

Catalog Number:
AG000F4E
Chemical Name:
1,2,4-Oxadiazole, 3-methyl-5-(1-methyl-3-pyrrolidinyl)-
CAS Number:
114724-47-9
Molecular Formula:
C8H13N3O
Molecular Weight:
167.2083
IUPAC Name:
3-methyl-5-(1-methylpyrrolidin-3-yl)-1,2,4-oxadiazole
InChI:
InChI=1S/C8H13N3O/c1-6-9-8(12-10-6)7-3-4-11(2)5-7/h7H,3-5H2,1-2H3
InChI Key:
GFEPBOWKWNAPQC-UHFFFAOYSA-N
SMILES:
CN1CCC(C1)c1onc(n1)C

Properties

Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.106g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.212g/mol
Monoisotopic Mass:
167.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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