2,2-difluorohex-5-en-1-ol

C6H10F2O — CID 150546008

IUPAC2,2-difluorohex-5-en-1-ol
SMILESC=CCCC(F)(F)CO
InChIInChI=1S/C6H10F2O/c1-2-3-4-6(7,8)5-9/h2,9H,1,3-5H2
InChIKeyIGWPITMBQDNTMT-UHFFFAOYSA-N
MW136.14 g/mol
LogP1.58
Rot. Bonds4

About 2,2-difluorohex-5-en-1-ol

2,2-difluorohex-5-en-1-ol (PubChem CID 150546008) has the molecular formula C6H10F2O and a molecular weight of 136.14 g/mol. Its IUPAC name is 2,2-difluorohex-5-en-1-ol.

Molecular Properties

Compound Name2,2-difluorohex-5-en-1-ol
PubChem CID150546008
Molecular FormulaC6H10F2O
Molecular Weight136.14 g/mol
Exact Mass136.07
IUPAC Name2,2-difluorohex-5-en-1-ol
SMILESC=CCCC(F)(F)CO
InChIInChI=1S/C6H10F2O/c1-2-3-4-6(7,8)5-9/h2,9H,1,3-5H2
InChIKeyIGWPITMBQDNTMT-UHFFFAOYSA-N
XLogP1.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.14
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-bromo-5,5-difluorohex-1-ene
CID 10512188
2-but-3-enyl-2-ethylhex-5-en-1-ol
CID 159922926
2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorotetradec-13-en-1-ol
CID 121403327
5-but-3-enoxy-5-fluoronona-1,8-diene
CID 122631410
2,2-dimethylhept-6-en-1-ol
CID 12063159
2-(hydroxymethyl)-2-non-8-enylpropane-1,3-diol
CID 11521477
5,5-bis(ethenyl)nona-1,8-diene
CID 100960520
(2R)-2-fluoro-2-methylpent-4-en-1-ol
CID 57283986
8,8,8-trifluorooct-1-ene
CID 11008282
2-fluoro-2-prop-2-enylpentane-1,5-diol
CID 146607254
but-3-en-1-ol;silane
CID 174710612
4,4-difluoro-5-hydroxypentanoate
CID 154359726

Frequently Asked Questions

What is the IUPAC name of 2,2-difluorohex-5-en-1-ol?
The IUPAC name of 2,2-difluorohex-5-en-1-ol (CID 150546008) is 2,2-difluorohex-5-en-1-ol.
What is the SMILES notation for 2,2-difluorohex-5-en-1-ol?
The canonical SMILES for 2,2-difluorohex-5-en-1-ol is C=CCCC(F)(F)CO.
What is the InChIKey of 2,2-difluorohex-5-en-1-ol?
The InChIKey is IGWPITMBQDNTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F2O/c1-2-3-4-6(7,8)5-9/h2,9H,1,3-5H2.
What are the key properties of 2,2-difluorohex-5-en-1-ol?
2,2-difluorohex-5-en-1-ol has a molecular weight of 136.14 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluorohex-5-en-1-ol is sourced from PubChem (CID 150546008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).