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88517-99-1 | 2H-Pyran, tetrahydro-2-(2-undecynyloxy)-
CAS No: 88517-99-1 Catalog No: AG004835 MDL No:
Product Description
Catalog Number:
AG004835
Chemical Name:
2H-Pyran, tetrahydro-2-(2-undecynyloxy)-
CAS Number:
88517-99-1
Molecular Formula:
C16H28O2
Molecular Weight:
252.3923
IUPAC Name:
2-undec-2-ynoxyoxane
InChI:
InChI=1S/C16H28O2/c1-2-3-4-5-6-7-8-9-11-14-17-16-13-10-12-15-18-16/h16H,2-8,10,12-15H2,1H3
InChI Key:
KILZHFHZFSGNMA-UHFFFAOYSA-N
SMILES:
CCCCCCCCC#CCOC1CCCCO1
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.209g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.398g/mol
Monoisotopic Mass:
252.209g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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