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88330-55-6 | Isoxazolidine, 3-(4-methoxyphenyl)-2-methyl-5-pentyl-
CAS No: 88330-55-6 Catalog No: AG0089NX MDL No:
Product Description
Catalog Number:
AG0089NX
Chemical Name:
Isoxazolidine, 3-(4-methoxyphenyl)-2-methyl-5-pentyl-
CAS Number:
88330-55-6
Molecular Formula:
C16H25NO2
Molecular Weight:
263.3752
IUPAC Name:
3-(4-methoxyphenyl)-2-methyl-5-pentyl-1,2-oxazolidine
InChI:
InChI=1S/C16H25NO2/c1-4-5-6-7-15-12-16(17(2)19-15)13-8-10-14(18-3)11-9-13/h8-11,15-16H,4-7,12H2,1-3H3
InChI Key:
IWTYZUAVPTYMAG-UHFFFAOYSA-N
SMILES:
CCCCCC1ON(C(C1)c1ccc(cc1)OC)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.189g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.381g/mol
Monoisotopic Mass:
263.189g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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