1-fluoro-3,7,11,15-tetramethylhexadecane

C20H41F — CID 123173855

IUPAC1-fluoro-3,7,11,15-tetramethylhexadecane
SMILESCC(C)CCCC(C)CCCC(C)CCCC(C)CCF
InChIInChI=1S/C20H41F/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h17-20H,6-16H2,1-5H3
InChIKeyHSQRYYGZZHOUQV-UHFFFAOYSA-N
MW300.55 g/mol
LogP7.42
Rot. Bonds14

About 1-fluoro-3,7,11,15-tetramethylhexadecane

1-fluoro-3,7,11,15-tetramethylhexadecane (PubChem CID 123173855) has the molecular formula C20H41F and a molecular weight of 300.55 g/mol. Its IUPAC name is 1-fluoro-3,7,11,15-tetramethylhexadecane.

Molecular Properties

Compound Name1-fluoro-3,7,11,15-tetramethylhexadecane
PubChem CID123173855
Molecular FormulaC20H41F
Molecular Weight300.55 g/mol
Exact Mass300.32
IUPAC Name1-fluoro-3,7,11,15-tetramethylhexadecane
SMILESCC(C)CCCC(C)CCCC(C)CCCC(C)CCF
InChIInChI=1S/C20H41F/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h17-20H,6-16H2,1-5H3
InChIKeyHSQRYYGZZHOUQV-UHFFFAOYSA-N
XLogP7.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.55
LogP ≤ 57.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3,7,11,15-tetramethylhexadecane?
The IUPAC name of 1-fluoro-3,7,11,15-tetramethylhexadecane (CID 123173855) is 1-fluoro-3,7,11,15-tetramethylhexadecane.
What is the SMILES notation for 1-fluoro-3,7,11,15-tetramethylhexadecane?
The canonical SMILES for 1-fluoro-3,7,11,15-tetramethylhexadecane is CC(C)CCCC(C)CCCC(C)CCCC(C)CCF.
What is the InChIKey of 1-fluoro-3,7,11,15-tetramethylhexadecane?
The InChIKey is HSQRYYGZZHOUQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41F/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h17-20H,6-16H2,1-5H3.
What are the key properties of 1-fluoro-3,7,11,15-tetramethylhexadecane?
1-fluoro-3,7,11,15-tetramethylhexadecane has a molecular weight of 300.55 g/mol, XLogP of 7.42, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3,7,11,15-tetramethylhexadecane is sourced from PubChem (CID 123173855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).