(Z)-1-fluoro-5-methylsulfanylpent-2-ene

C6H11FS — CID 89423732

IUPAC(Z)-1-fluoro-5-methylsulfanylpent-2-ene
SMILESCSCC/C=C\CF
InChIInChI=1S/C6H11FS/c1-8-6-4-2-3-5-7/h2-3H,4-6H2,1H3/b3-2-
InChIKeySQPHSEGEYAULMM-IHWYPQMZSA-N
MW134.22 g/mol
LogP2.27
Rot. Bonds4

About (Z)-1-fluoro-5-methylsulfanylpent-2-ene

(Z)-1-fluoro-5-methylsulfanylpent-2-ene (PubChem CID 89423732) has the molecular formula C6H11FS and a molecular weight of 134.22 g/mol. Its IUPAC name is (Z)-1-fluoro-5-methylsulfanylpent-2-ene.

Molecular Properties

Compound Name(Z)-1-fluoro-5-methylsulfanylpent-2-ene
PubChem CID89423732
Molecular FormulaC6H11FS
Molecular Weight134.22 g/mol
Exact Mass134.06
IUPAC Name(Z)-1-fluoro-5-methylsulfanylpent-2-ene
SMILESCSCC/C=C\CF
InChIInChI=1S/C6H11FS/c1-8-6-4-2-3-5-7/h2-3H,4-6H2,1H3/b3-2-
InChIKeySQPHSEGEYAULMM-IHWYPQMZSA-N
XLogP2.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-fluoro-5-methylsulfanylpent-2-ene?
The IUPAC name of (Z)-1-fluoro-5-methylsulfanylpent-2-ene (CID 89423732) is (Z)-1-fluoro-5-methylsulfanylpent-2-ene.
What is the SMILES notation for (Z)-1-fluoro-5-methylsulfanylpent-2-ene?
The canonical SMILES for (Z)-1-fluoro-5-methylsulfanylpent-2-ene is CSCC/C=C\CF.
What is the InChIKey of (Z)-1-fluoro-5-methylsulfanylpent-2-ene?
The InChIKey is SQPHSEGEYAULMM-IHWYPQMZSA-N. The full InChI is InChI=1S/C6H11FS/c1-8-6-4-2-3-5-7/h2-3H,4-6H2,1H3/b3-2-.
What are the key properties of (Z)-1-fluoro-5-methylsulfanylpent-2-ene?
(Z)-1-fluoro-5-methylsulfanylpent-2-ene has a molecular weight of 134.22 g/mol, XLogP of 2.27, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-fluoro-5-methylsulfanylpent-2-ene is sourced from PubChem (CID 89423732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).