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88056-98-8 | 5H-Oxazolo[3,2-a]pyridine, hexahydro-3-phenyl-5-propyl-
CAS No: 88056-98-8 Catalog No: AG004FGL MDL No:
Product Description
Catalog Number:
AG004FGL
Chemical Name:
5H-Oxazolo[3,2-a]pyridine, hexahydro-3-phenyl-5-propyl-
CAS Number:
88056-98-8
Molecular Formula:
C16H23NO
Molecular Weight:
245.3599
IUPAC Name:
3-phenyl-5-propyl-3,5,6,7,8,8a-hexahydro-2H-[1,3]oxazolo[3,2-a]pyridine
InChI:
InChI=1S/C16H23NO/c1-2-7-14-10-6-11-16-17(14)15(12-18-16)13-8-4-3-5-9-13/h3-5,8-9,14-16H,2,6-7,10-12H2,1H3
InChI Key:
MMRHZVHXMBZJQT-UHFFFAOYSA-N
SMILES:
CCCC1CCCC2N1C(CO2)c1ccccc1
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.178g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.366g/mol
Monoisotopic Mass:
245.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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