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1363994-23-3 | Piperidine, 4-(3-phenyl-5-isoxazolyl)-, hydrochloride (1:1)
CAS No: 1363994-23-3 Catalog No: AG0011TW MDL No:
Product Description
Catalog Number:
AG0011TW
Chemical Name:
Piperidine, 4-(3-phenyl-5-isoxazolyl)-, hydrochloride (1:1)
CAS Number:
1363994-23-3
Molecular Formula:
C14H17ClN2O
Molecular Weight:
264.7506
IUPAC Name:
3-phenyl-5-piperidin-4-yl-1,2-oxazole;hydrochloride
InChI:
InChI=1S/C14H16N2O.ClH/c1-2-4-11(5-3-1)13-10-14(17-16-13)12-6-8-15-9-7-12;/h1-5,10,12,15H,6-9H2;1H
InChI Key:
SHGZZDZFAJEZIF-UHFFFAOYSA-N
SMILES:
N1CCC(CC1)c1onc(c1)c1ccccc1.Cl
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.103g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.753g/mol
Monoisotopic Mass:
264.103g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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