1-chloro-9-fluoronon-1-ene

C9H16ClF — CID 175497704

IUPAC1-chloro-9-fluoronon-1-ene
SMILESFCCCCCCCC=CCl
InChIInChI=1S/C9H16ClF/c10-8-6-4-2-1-3-5-7-9-11/h6,8H,1-5,7,9H2
InChIKeyXTMHBJINLJBJPY-UHFFFAOYSA-N
MW178.68 g/mol
LogP4.05
Rot. Bonds7

About 1-chloro-9-fluoronon-1-ene

1-chloro-9-fluoronon-1-ene (PubChem CID 175497704) has the molecular formula C9H16ClF and a molecular weight of 178.68 g/mol. Its IUPAC name is 1-chloro-9-fluoronon-1-ene.

Molecular Properties

Compound Name1-chloro-9-fluoronon-1-ene
PubChem CID175497704
Molecular FormulaC9H16ClF
Molecular Weight178.68 g/mol
Exact Mass178.09
IUPAC Name1-chloro-9-fluoronon-1-ene
SMILESFCCCCCCCC=CCl
InChIInChI=1S/C9H16ClF/c10-8-6-4-2-1-3-5-7-9-11/h6,8H,1-5,7,9H2
InChIKeyXTMHBJINLJBJPY-UHFFFAOYSA-N
XLogP4.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.68
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-chloro-5-fluoropent-1-ene
CID 54369984
1,14-difluorotetradec-1-ene
CID 173198154
8-chlorooct-7-en-1-ol
CID 57208021
(E)-1-chlorododec-1-ene
CID 6438318
(Z)-14-fluorotetradec-3-en-1-ol
CID 86739508
1-chlorohept-1-ene
CID 520074
6-fluoro-1-(6-fluorohex-1-enoxy)hex-1-ene
CID 91221242
(5Z,8Z,11Z,14Z)-1-fluorohenicosa-5,8,11,14-tetraene
CID 159191741
12-fluorododecanal
CID 24837741
6-fluorohexanal
CID 9769
1,9-difluorononane;hydrochloride
CID 174355742
(1E,5E)-1,7-dichlorohepta-1,5-diene
CID 55303187

Frequently Asked Questions

What is the IUPAC name of 1-chloro-9-fluoronon-1-ene?
The IUPAC name of 1-chloro-9-fluoronon-1-ene (CID 175497704) is 1-chloro-9-fluoronon-1-ene.
What is the SMILES notation for 1-chloro-9-fluoronon-1-ene?
The canonical SMILES for 1-chloro-9-fluoronon-1-ene is FCCCCCCCC=CCl.
What is the InChIKey of 1-chloro-9-fluoronon-1-ene?
The InChIKey is XTMHBJINLJBJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16ClF/c10-8-6-4-2-1-3-5-7-9-11/h6,8H,1-5,7,9H2.
What are the key properties of 1-chloro-9-fluoronon-1-ene?
1-chloro-9-fluoronon-1-ene has a molecular weight of 178.68 g/mol, XLogP of 4.05, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-9-fluoronon-1-ene is sourced from PubChem (CID 175497704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).