(3S)-3-fluoropent-1-ene

C5H9F — CID 122210024

IUPAC(3S)-3-fluoropent-1-ene
SMILESC=C[C@@H](F)CC
InChIInChI=1S/C5H9F/c1-3-5(6)4-2/h3,5H,1,4H2,2H3/t5-/m1/s1
InChIKeyOZSQOSMBDJJIIJ-RXMQYKEDSA-N
MW88.12 g/mol
LogP1.92
Rot. Bonds2

About (3S)-3-fluoropent-1-ene

(3S)-3-fluoropent-1-ene (PubChem CID 122210024) has the molecular formula C5H9F and a molecular weight of 88.12 g/mol. Its IUPAC name is (3S)-3-fluoropent-1-ene.

Molecular Properties

Compound Name(3S)-3-fluoropent-1-ene
PubChem CID122210024
Molecular FormulaC5H9F
Molecular Weight88.12 g/mol
Exact Mass88.07
IUPAC Name(3S)-3-fluoropent-1-ene
SMILESC=C[C@@H](F)CC
InChIInChI=1S/C5H9F/c1-3-5(6)4-2/h3,5H,1,4H2,2H3/t5-/m1/s1
InChIKeyOZSQOSMBDJJIIJ-RXMQYKEDSA-N
XLogP1.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.12
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-3-fluorobut-1-ene
CID 13147000
CID 18366418
CID 18366418
4-fluoro-2-methylhex-5-en-2-amine
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(3R)-3-fluoropent-4-en-1-ol
CID 101459116
3-(difluoromethyl)-5,5-difluoro-4-methylpent-1-ene
CID 123767607
N-(2-fluorobutylidene)hydroxylamine
CID 154368227
1,1,4-trifluorohexa-1,5-diene
CID 87427925
(Z)-3-fluorooct-4-ene
CID 143337170
4-ethenyl-3,5-dimethylheptane
CID 90755259
(3R)-5,5-difluoro-3-methylpent-1-ene
CID 137420018
1,1-difluoro-2-methylpropane;2-fluoro-4-methylpentane;methane;2-methylbutane;3-methylbut-1-ene
CID 157324404
(3S)-hex-5-en-3-ol
CID 10749148

Frequently Asked Questions

What is the IUPAC name of (3S)-3-fluoropent-1-ene?
The IUPAC name of (3S)-3-fluoropent-1-ene (CID 122210024) is (3S)-3-fluoropent-1-ene.
What is the SMILES notation for (3S)-3-fluoropent-1-ene?
The canonical SMILES for (3S)-3-fluoropent-1-ene is C=C[C@@H](F)CC.
What is the InChIKey of (3S)-3-fluoropent-1-ene?
The InChIKey is OZSQOSMBDJJIIJ-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H9F/c1-3-5(6)4-2/h3,5H,1,4H2,2H3/t5-/m1/s1.
What are the key properties of (3S)-3-fluoropent-1-ene?
(3S)-3-fluoropent-1-ene has a molecular weight of 88.12 g/mol, XLogP of 1.92, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-fluoropent-1-ene is sourced from PubChem (CID 122210024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).