10-methoxy-6,10-dimethylundecan-2-one

C14H28O2 — CID 15595758

IUPAC10-methoxy-6,10-dimethylundecan-2-one
SMILESCOC(C)(C)CCCC(C)CCCC(C)=O
InChIInChI=1S/C14H28O2/c1-12(8-6-10-13(2)15)9-7-11-14(3,4)16-5/h12H,6-11H2,1-5H3
InChIKeyCZKHFSCCPRLTCE-UHFFFAOYSA-N
MW228.38 g/mol
LogP3.98
Rot. Bonds9

About 10-methoxy-6,10-dimethylundecan-2-one

10-methoxy-6,10-dimethylundecan-2-one (PubChem CID 15595758) has the molecular formula C14H28O2 and a molecular weight of 228.38 g/mol. Its IUPAC name is 10-methoxy-6,10-dimethylundecan-2-one.

Molecular Properties

Compound Name10-methoxy-6,10-dimethylundecan-2-one
PubChem CID15595758
Molecular FormulaC14H28O2
Molecular Weight228.38 g/mol
Exact Mass228.21
IUPAC Name10-methoxy-6,10-dimethylundecan-2-one
SMILESCOC(C)(C)CCCC(C)CCCC(C)=O
InChIInChI=1S/C14H28O2/c1-12(8-6-10-13(2)15)9-7-11-14(3,4)16-5/h12H,6-11H2,1-5H3
InChIKeyCZKHFSCCPRLTCE-UHFFFAOYSA-N
XLogP3.98
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-methoxy-6,10-dimethylundecan-2-one?
The IUPAC name of 10-methoxy-6,10-dimethylundecan-2-one (CID 15595758) is 10-methoxy-6,10-dimethylundecan-2-one.
What is the SMILES notation for 10-methoxy-6,10-dimethylundecan-2-one?
The canonical SMILES for 10-methoxy-6,10-dimethylundecan-2-one is COC(C)(C)CCCC(C)CCCC(C)=O.
What is the InChIKey of 10-methoxy-6,10-dimethylundecan-2-one?
The InChIKey is CZKHFSCCPRLTCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O2/c1-12(8-6-10-13(2)15)9-7-11-14(3,4)16-5/h12H,6-11H2,1-5H3.
What are the key properties of 10-methoxy-6,10-dimethylundecan-2-one?
10-methoxy-6,10-dimethylundecan-2-one has a molecular weight of 228.38 g/mol, XLogP of 3.98, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methoxy-6,10-dimethylundecan-2-one is sourced from PubChem (CID 15595758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).