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2H-Pyran, 2-(9-decenyloxy)tetrahydro-

CAS：67136-13-4
MW:240.38
MF：C15H28O2

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Names and ldentifier
Computational chemical data
Realated Product Infomation

1. Names and Identifiers

1.1 Name: 2H-Pyran, 2-(9-decenyloxy)tetrahydro-

1.2 Synonyms: 2-(9-Decenyloxy)tetrahydro-2H-pyran; 2-dec-9-enoxyoxane; CTK1J3854; DTXSID70471788;

1.3 CAS No.: 67136-13-4

1.4 CID: 11746754

1.5 Molecular Formula: C15H28O2

1.6 Inchi: InChI=1S/C15H28O2/c1-2-3-4-5-6-7-8-10-13-16-15-12-9-11-14-17-15/h2,15H,1,3-14H2

1.7 InChkey: UHHDVZVTDYIKML-UHFFFAOYSA-N

1.8 Canonical Smiles: C=CCCCCCCCCOC1CCCCO1

1.9 Isomers Smiles: C=CCCCCCCCCOC1CCCCO1

2. Synthesis Route

67136-13-4Total: 7 Synthesis Route

19754-58-6

67136-13-4

106094-31-9

67136-13-4

View all

3. Precursor and Product

precursor:

106094-37-5

106094-35-3

110-87-2

106094-31-9

106094-33-1

106094-34-2

13019-22-2

19754-58-6

106094-32-0

product:

76387-42-3

97987-89-8

112-30-1

110477-35-5

13019-22-2

70863-80-8

19754-58-6

82380-21-0

4. Computed Properties

Molecular Weight：240.38g/mol
Molecular Formula：C₁₅H₂₈O₂
Compound Is Canonicalized：True
Exact Mass：4.9
XLogP3-AA：240.208930132
Monoisotopic Mass：240.208930132
Complexity：180
Rotatable Bond Count：10
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：2
Topological Polar Surface Area：18.5
Heavy Atom Count：：17
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：1
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：0
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADceBwMAAAAAAAAAAAAAAAAAAAAAAAAAAkAAAAAAAAAAAAAAAAGgAAAAAACACwgAMACAAABACAACBCAAAAAAAgAAAIAAAAAAgQAAIAAQAiAAAEgAAEAAGA4KgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

5. Realated Product Infomation

1. Names and Identifiers

1.1 Name
1.2 Synonyms
1.3 CAS No.
1.4 Molecular Formula
1.5 Inchi
1.6 InChkey
1.7 Canonical Smiles
1.8 Isomers Smiles

2. Synthesis Route

3. Precursor and Product

4. Computational chemical data

5. Realated Product Infomation

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