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88444-19-3 | 2H-Pyran-2,6(3H)-dione, 4-(10-cyclohexyldecyl)dihydro-
CAS No: 88444-19-3 Catalog No: AG004EMU MDL No:
Product Description
Catalog Number:
AG004EMU
Chemical Name:
2H-Pyran-2,6(3H)-dione, 4-(10-cyclohexyldecyl)dihydro-
CAS Number:
88444-19-3
Molecular Formula:
C21H36O3
Molecular Weight:
336.5087
IUPAC Name:
4-(10-cyclohexyldecyl)oxane-2,6-dione
InChI:
InChI=1S/C21H36O3/c22-20-16-19(17-21(23)24-20)15-9-6-4-2-1-3-5-8-12-18-13-10-7-11-14-18/h18-19H,1-17H2
InChI Key:
RLTZXXJVUUNETP-UHFFFAOYSA-N
SMILES:
O=C1CC(CCCCCCCCCCC2CCCCC2)CC(=O)O1
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.266g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
336.516g/mol
Monoisotopic Mass:
336.266g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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