(8E,10E)-8,9-difluorododeca-8,10-dien-1-ol

C12H20F2O — CID 14310978

IUPAC(8E,10E)-8,9-difluorododeca-8,10-dien-1-ol
SMILESC/C=C/C(F)=C(\F)CCCCCCCO
InChIInChI=1S/C12H20F2O/c1-2-8-11(13)12(14)9-6-4-3-5-7-10-15/h2,8,15H,3-7,9-10H2,1H3/b8-2+,12-11+
InChIKeyDOTRBGLRYVSEAI-XNFWGEGYSA-N
MW218.29 g/mol
LogP4.05
Rot. Bonds8

About (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol

(8E,10E)-8,9-difluorododeca-8,10-dien-1-ol (PubChem CID 14310978) has the molecular formula C12H20F2O and a molecular weight of 218.29 g/mol. Its IUPAC name is (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol.

Molecular Properties

Compound Name(8E,10E)-8,9-difluorododeca-8,10-dien-1-ol
PubChem CID14310978
Molecular FormulaC12H20F2O
Molecular Weight218.29 g/mol
Exact Mass218.15
IUPAC Name(8E,10E)-8,9-difluorododeca-8,10-dien-1-ol
SMILESC/C=C/C(F)=C(\F)CCCCCCCO
InChIInChI=1S/C12H20F2O/c1-2-8-11(13)12(14)9-6-4-3-5-7-10-15/h2,8,15H,3-7,9-10H2,1H3/b8-2+,12-11+
InChIKeyDOTRBGLRYVSEAI-XNFWGEGYSA-N
XLogP4.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 54.05
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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Frequently Asked Questions

What is the IUPAC name of (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol?
The IUPAC name of (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol (CID 14310978) is (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol.
What is the SMILES notation for (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol?
The canonical SMILES for (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol is C/C=C/C(F)=C(\F)CCCCCCCO.
What is the InChIKey of (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol?
The InChIKey is DOTRBGLRYVSEAI-XNFWGEGYSA-N. The full InChI is InChI=1S/C12H20F2O/c1-2-8-11(13)12(14)9-6-4-3-5-7-10-15/h2,8,15H,3-7,9-10H2,1H3/b8-2+,12-11+.
What are the key properties of (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol?
(8E,10E)-8,9-difluorododeca-8,10-dien-1-ol has a molecular weight of 218.29 g/mol, XLogP of 4.05, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8E,10E)-8,9-difluorododeca-8,10-dien-1-ol is sourced from PubChem (CID 14310978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).