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1509664-33-8 | 4-(3,5-Dimethyl-isoxazol-4-yl)-piperidine
CAS No: 1509664-33-8 Catalog No: AG019GFB MDL No:MFCD22065034
Product Description
Catalog Number:
AG019GFB
Chemical Name:
4-(3,5-Dimethyl-isoxazol-4-yl)-piperidine
CAS Number:
1509664-33-8
Molecular Formula:
C10H16N2O
Molecular Weight:
180.2468
MDL Number:
MFCD22065034
IUPAC Name:
3,5-dimethyl-4-piperidin-4-yl-1,2-oxazole
InChI:
InChI=1S/C10H16N2O/c1-7-10(8(2)13-12-7)9-3-5-11-6-4-9/h9,11H,3-6H2,1-2H3
InChI Key:
KOXCMNMGWFXEIW-UHFFFAOYSA-N
SMILES:
Cc1onc(c1C1CCNCC1)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.126g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.251g/mol
Monoisotopic Mass:
180.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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