(Z)-7-fluoro-11-methyldodec-7-en-6-ol

C13H25FO — CID 134863102

IUPAC(Z)-7-fluoro-11-methyldodec-7-en-6-ol
SMILESCCCCCC(O)/C(F)=C/CCC(C)C
InChIInChI=1S/C13H25FO/c1-4-5-6-10-13(15)12(14)9-7-8-11(2)3/h9,11,13,15H,4-8,10H2,1-3H3/b12-9-
InChIKeyDVTQUJSDGIHCQG-XFXZXTDPSA-N
MW216.34 g/mol
LogP4.22
Rot. Bonds8

About (Z)-7-fluoro-11-methyldodec-7-en-6-ol

(Z)-7-fluoro-11-methyldodec-7-en-6-ol (PubChem CID 134863102) has the molecular formula C13H25FO and a molecular weight of 216.34 g/mol. Its IUPAC name is (Z)-7-fluoro-11-methyldodec-7-en-6-ol.

Molecular Properties

Compound Name(Z)-7-fluoro-11-methyldodec-7-en-6-ol
PubChem CID134863102
Molecular FormulaC13H25FO
Molecular Weight216.34 g/mol
Exact Mass216.19
IUPAC Name(Z)-7-fluoro-11-methyldodec-7-en-6-ol
SMILESCCCCCC(O)/C(F)=C/CCC(C)C
InChIInChI=1S/C13H25FO/c1-4-5-6-10-13(15)12(14)9-7-8-11(2)3/h9,11,13,15H,4-8,10H2,1-3H3/b12-9-
InChIKeyDVTQUJSDGIHCQG-XFXZXTDPSA-N
XLogP4.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.34
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 58304612
(2R)-heptan-2-ol
CID 6992611
2-methyl-6-propyltridec-5-ene
CID 91251562
(Z)-tridec-7-en-2-ol
CID 89138962
6-ethyl-2-methyldec-5-ene
CID 123276587
heptan-2-ol;hydroxylamine
CID 88625997
octan-2-ol
CID 20083
(2S)-heptan-2-ol;hydrochloride
CID 141119609
docosan-2-ol
CID 14151025
(2S)-octadecan-2-ol
CID 25022019

Frequently Asked Questions

What is the IUPAC name of (Z)-7-fluoro-11-methyldodec-7-en-6-ol?
The IUPAC name of (Z)-7-fluoro-11-methyldodec-7-en-6-ol (CID 134863102) is (Z)-7-fluoro-11-methyldodec-7-en-6-ol.
What is the SMILES notation for (Z)-7-fluoro-11-methyldodec-7-en-6-ol?
The canonical SMILES for (Z)-7-fluoro-11-methyldodec-7-en-6-ol is CCCCCC(O)/C(F)=C/CCC(C)C.
What is the InChIKey of (Z)-7-fluoro-11-methyldodec-7-en-6-ol?
The InChIKey is DVTQUJSDGIHCQG-XFXZXTDPSA-N. The full InChI is InChI=1S/C13H25FO/c1-4-5-6-10-13(15)12(14)9-7-8-11(2)3/h9,11,13,15H,4-8,10H2,1-3H3/b12-9-.
What are the key properties of (Z)-7-fluoro-11-methyldodec-7-en-6-ol?
(Z)-7-fluoro-11-methyldodec-7-en-6-ol has a molecular weight of 216.34 g/mol, XLogP of 4.22, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-7-fluoro-11-methyldodec-7-en-6-ol is sourced from PubChem (CID 134863102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).