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115407-68-6 | 2H-Pyran-2-one, tetrahydro-6,6-dipropyl-
CAS No: 115407-68-6 Catalog No: AG000FY6 MDL No:
Product Description
Catalog Number:
AG000FY6
Chemical Name:
2H-Pyran-2-one, tetrahydro-6,6-dipropyl-
CAS Number:
115407-68-6
Molecular Formula:
C11H20O2
Molecular Weight:
184.2753
IUPAC Name:
6,6-dipropyloxan-2-one
InChI:
InChI=1S/C11H20O2/c1-3-7-11(8-4-2)9-5-6-10(12)13-11/h3-9H2,1-2H3
InChI Key:
PFKNXQCMZHDUNX-UHFFFAOYSA-N
SMILES:
CCCC1(CCC)CCCC(=O)O1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.146g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.279g/mol
Monoisotopic Mass:
184.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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