2,2-dimethoxy-6,10,14-trimethylpentadecane

C20H42O2 — CID 118520250

IUPAC2,2-dimethoxy-6,10,14-trimethylpentadecane
SMILESCOC(C)(CCCC(C)CCCC(C)CCCC(C)C)OC
InChIInChI=1S/C20H42O2/c1-17(2)11-8-12-18(3)13-9-14-19(4)15-10-16-20(5,21-6)22-7/h17-19H,8-16H2,1-7H3
InChIKeyOINAUZAZTSKBGK-UHFFFAOYSA-N
MW314.55 g/mol
LogP6.43
Rot. Bonds14

About 2,2-dimethoxy-6,10,14-trimethylpentadecane

2,2-dimethoxy-6,10,14-trimethylpentadecane (PubChem CID 118520250) has the molecular formula C20H42O2 and a molecular weight of 314.55 g/mol. Its IUPAC name is 2,2-dimethoxy-6,10,14-trimethylpentadecane.

Molecular Properties

Compound Name2,2-dimethoxy-6,10,14-trimethylpentadecane
PubChem CID118520250
Molecular FormulaC20H42O2
Molecular Weight314.55 g/mol
Exact Mass314.32
IUPAC Name2,2-dimethoxy-6,10,14-trimethylpentadecane
SMILESCOC(C)(CCCC(C)CCCC(C)CCCC(C)C)OC
InChIInChI=1S/C20H42O2/c1-17(2)11-8-12-18(3)13-9-14-19(4)15-10-16-20(5,21-6)22-7/h17-19H,8-16H2,1-7H3
InChIKeyOINAUZAZTSKBGK-UHFFFAOYSA-N
XLogP6.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.55
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

14-methoxy-2,6,10,14-tetramethylhexadecane
CID 91173941
methane;2,2,5,9,13-pentamethyltetradecane
CID 159071940
(E)-2,2-dimethoxy-6,10-dimethylundec-5-ene
CID 23352870
3-ethyl-2,2,3,7,11-pentamethyldodecane
CID 166045645
2,5,9,13-tetramethyltetradecane
CID 58292409
1-methoxy-4,8-dimethylnonane
CID 90974533
2-hydroxy-2,6,10,14-tetramethylpentadecanenitrile
CID 3268041
(2R,6R,10R)-2,6,10,14-tetramethylpentadecan-1-ol
CID 170847769
(2S,6S)-6,10-dimethylundecan-2-ol
CID 92938997
3,7-dimethyloctan-1-ol
CID 7792
2,2,7,13-tetramethyltetradecane
CID 164934007
(3R)-1,1-dihydroperoxy-3,7-dimethyloctan-1-ol
CID 137446443

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethoxy-6,10,14-trimethylpentadecane?
The IUPAC name of 2,2-dimethoxy-6,10,14-trimethylpentadecane (CID 118520250) is 2,2-dimethoxy-6,10,14-trimethylpentadecane.
What is the SMILES notation for 2,2-dimethoxy-6,10,14-trimethylpentadecane?
The canonical SMILES for 2,2-dimethoxy-6,10,14-trimethylpentadecane is COC(C)(CCCC(C)CCCC(C)CCCC(C)C)OC.
What is the InChIKey of 2,2-dimethoxy-6,10,14-trimethylpentadecane?
The InChIKey is OINAUZAZTSKBGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42O2/c1-17(2)11-8-12-18(3)13-9-14-19(4)15-10-16-20(5,21-6)22-7/h17-19H,8-16H2,1-7H3.
What are the key properties of 2,2-dimethoxy-6,10,14-trimethylpentadecane?
2,2-dimethoxy-6,10,14-trimethylpentadecane has a molecular weight of 314.55 g/mol, XLogP of 6.43, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethoxy-6,10,14-trimethylpentadecane is sourced from PubChem (CID 118520250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).