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737766-70-0 | 4-(5-phenyl-3-isoxazolyl)piperidine
CAS No: 737766-70-0 Catalog No: AG00FH36 MDL No:
Product Description
Catalog Number:
AG00FH36
Chemical Name:
4-(5-phenyl-3-isoxazolyl)piperidine
CAS Number:
737766-70-0
IUPAC Name:
5-phenyl-3-piperidin-4-yl-1,2-oxazole
InChI:
InChI=1S/C14H16N2O/c1-2-4-12(5-3-1)14-10-13(16-17-14)11-6-8-15-9-7-11/h1-5,10-11,15H,6-9H2
InChI Key:
BGJNNBKNDJFABG-UHFFFAOYSA-N
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.295g/mol
Monoisotopic Mass:
228.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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