10,10,10-trifluoro-3-methylidenedec-4-en-2-ol

C11H17F3O — CID 123209839

IUPAC10,10,10-trifluoro-3-methylidenedec-4-en-2-ol
SMILESC=C(C=CCCCCC(F)(F)F)C(C)O
InChIInChI=1S/C11H17F3O/c1-9(10(2)15)7-5-3-4-6-8-11(12,13)14/h5,7,10,15H,1,3-4,6,8H2,2H3
InChIKeyHMGYTCYSJSWLMK-UHFFFAOYSA-N
MW222.25 g/mol
LogP3.60
Rot. Bonds6

About 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol

10,10,10-trifluoro-3-methylidenedec-4-en-2-ol (PubChem CID 123209839) has the molecular formula C11H17F3O and a molecular weight of 222.25 g/mol. Its IUPAC name is 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol.

Molecular Properties

Compound Name10,10,10-trifluoro-3-methylidenedec-4-en-2-ol
PubChem CID123209839
Molecular FormulaC11H17F3O
Molecular Weight222.25 g/mol
Exact Mass222.12
IUPAC Name10,10,10-trifluoro-3-methylidenedec-4-en-2-ol
SMILESC=C(C=CCCCCC(F)(F)F)C(C)O
InChIInChI=1S/C11H17F3O/c1-9(10(2)15)7-5-3-4-6-8-11(12,13)14/h5,7,10,15H,1,3-4,6,8H2,2H3
InChIKeyHMGYTCYSJSWLMK-UHFFFAOYSA-N
XLogP3.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

2,6-Dimethylocta-1,5,7-trien-3-ol
CID 5362854
2,6-Dimethyl-1,5,7-octatrien-3-ol
CID 119847
(E)-7-Methyl-3-methyleneocta-4,6-dien-2-ol
CID 6436559
(3R,5E)-2,6-dimethylocta-1,5,7-trien-3-ol
CID 92256191
(Z)-Ocimenol
CID 22163404
(3R,5Z)-2,6-dimethylocta-1,5,7-trien-3-ol
CID 92256190
4,4,5-Trifluoro-6-methylhepta-1,5-dien-3-ol
CID 12082274
Cyclohexa-2,4-dien-1-ol;1,1,1-trifluoroethane
CID 139242861
2-(Trifluoromethyl)cyclohexa-2,4-dien-1-ol
CID 139242864
(3E,5E)-1,1,1-trifluorodeca-3,5-dien-2-ol
CID 71485097
(E)-1,1,1-trifluorodec-4-en-2-ol
CID 15074573
6-Methylidene-4-(trifluoromethyl)cyclohexa-2,4-dien-1-ol
CID 21257323

Frequently Asked Questions

What is the IUPAC name of 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol?
The IUPAC name of 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol (CID 123209839) is 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol.
What is the SMILES notation for 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol?
The canonical SMILES for 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol is C=C(C=CCCCCC(F)(F)F)C(C)O.
What is the InChIKey of 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol?
The InChIKey is HMGYTCYSJSWLMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3O/c1-9(10(2)15)7-5-3-4-6-8-11(12,13)14/h5,7,10,15H,1,3-4,6,8H2,2H3.
What are the key properties of 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol?
10,10,10-trifluoro-3-methylidenedec-4-en-2-ol has a molecular weight of 222.25 g/mol, XLogP of 3.60, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10,10-trifluoro-3-methylidenedec-4-en-2-ol is sourced from PubChem (CID 123209839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).