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19969-14-3 | Isoxazolidine, 2-methyl-5-pentyl-3-phenyl-
CAS No: 19969-14-3 Catalog No: AG002CAE MDL No:
Product Description
Catalog Number:
AG002CAE
Chemical Name:
Isoxazolidine, 2-methyl-5-pentyl-3-phenyl-
CAS Number:
19969-14-3
Molecular Formula:
C15H23NO
Molecular Weight:
233.3492
IUPAC Name:
2-methyl-5-pentyl-3-phenyl-1,2-oxazolidine
InChI:
InChI=1S/C15H23NO/c1-3-4-6-11-14-12-15(16(2)17-14)13-9-7-5-8-10-13/h5,7-10,14-15H,3-4,6,11-12H2,1-2H3
InChI Key:
SVWJZUHGLVIESB-UHFFFAOYSA-N
SMILES:
CCCCCC1CC(N(O1)C)c1ccccc1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.178g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.355g/mol
Monoisotopic Mass:
233.178g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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