7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol

C10H15F7O — CID 58419071

IUPAC7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol
SMILESCC(F)(CCCC(CCO)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H15F7O/c1-8(11,10(15,16)17)5-2-3-7(4-6-18)9(12,13)14/h7,18H,2-6H2,1H3
InChIKeyJWONQKOPPQGBFS-UHFFFAOYSA-N
MW284.22 g/mol
LogP4.01
Rot. Bonds6

About 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol

7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol (PubChem CID 58419071) has the molecular formula C10H15F7O and a molecular weight of 284.22 g/mol. Its IUPAC name is 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol.

Molecular Properties

Compound Name7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol
PubChem CID58419071
Molecular FormulaC10H15F7O
Molecular Weight284.22 g/mol
Exact Mass284.10
IUPAC Name7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol
SMILESCC(F)(CCCC(CCO)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H15F7O/c1-8(11,10(15,16)17)5-2-3-7(4-6-18)9(12,13)14/h7,18H,2-6H2,1H3
InChIKeyJWONQKOPPQGBFS-UHFFFAOYSA-N
XLogP4.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.22
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol?
The IUPAC name of 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol (CID 58419071) is 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol.
What is the SMILES notation for 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol?
The canonical SMILES for 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol is CC(F)(CCCC(CCO)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol?
The InChIKey is JWONQKOPPQGBFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F7O/c1-8(11,10(15,16)17)5-2-3-7(4-6-18)9(12,13)14/h7,18H,2-6H2,1H3.
What are the key properties of 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol?
7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol has a molecular weight of 284.22 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8,8,8-tetrafluoro-7-methyl-3-(trifluoromethyl)octan-1-ol is sourced from PubChem (CID 58419071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).