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115651-90-6 | 2H-Pyran, 2-[(7,7-dimethyl-5-octyn-1-yl)oxy]tetrahydro-
CAS No: 115651-90-6 Catalog No: AG000GOI MDL No:
Product Description
Catalog Number:
AG000GOI
Chemical Name:
2H-Pyran, 2-[(7,7-dimethyl-5-octyn-1-yl)oxy]tetrahydro-
CAS Number:
115651-90-6
Molecular Formula:
C15H26O2
Molecular Weight:
238.3657
IUPAC Name:
2-(7,7-dimethyloct-5-ynoxy)oxane
InChI:
InChI=1S/C15H26O2/c1-15(2,3)11-7-4-5-8-12-16-14-10-6-9-13-17-14/h14H,4-6,8-10,12-13H2,1-3H3
InChI Key:
KNOLCORRQHQRNJ-UHFFFAOYSA-N
SMILES:
CC(C#CCCCCOC1CCCCO1)(C)C
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.193g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.371g/mol
Monoisotopic Mass:
238.193g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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