1,9-difluorononane;hydrochloride

C9H19ClF2 — CID 174355742

IUPAC1,9-difluorononane;hydrochloride
SMILESCl.FCCCCCCCCCF
InChIInChI=1S/C9H18F2.ClH/c10-8-6-4-2-1-3-5-7-9-11;/h1-9H2;1H
InChIKeyQDHDIRVOTXDTEN-UHFFFAOYSA-N
MW200.70 g/mol
LogP4.08
Rot. Bonds8

About 1,9-difluorononane;hydrochloride

1,9-difluorononane;hydrochloride (PubChem CID 174355742) has the molecular formula C9H19ClF2 and a molecular weight of 200.70 g/mol. Its IUPAC name is 1,9-difluorononane;hydrochloride.

Molecular Properties

Compound Name1,9-difluorononane;hydrochloride
PubChem CID174355742
Molecular FormulaC9H19ClF2
Molecular Weight200.70 g/mol
Exact Mass200.11
IUPAC Name1,9-difluorononane;hydrochloride
SMILESCl.FCCCCCCCCCF
InChIInChI=1S/C9H18F2.ClH/c10-8-6-4-2-1-3-5-7-9-11;/h1-9H2;1H
InChIKeyQDHDIRVOTXDTEN-UHFFFAOYSA-N
XLogP4.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.70
LogP ≤ 54.08
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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Frequently Asked Questions

What is the IUPAC name of 1,9-difluorononane;hydrochloride?
The IUPAC name of 1,9-difluorononane;hydrochloride (CID 174355742) is 1,9-difluorononane;hydrochloride.
What is the SMILES notation for 1,9-difluorononane;hydrochloride?
The canonical SMILES for 1,9-difluorononane;hydrochloride is Cl.FCCCCCCCCCF.
What is the InChIKey of 1,9-difluorononane;hydrochloride?
The InChIKey is QDHDIRVOTXDTEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2.ClH/c10-8-6-4-2-1-3-5-7-9-11;/h1-9H2;1H.
What are the key properties of 1,9-difluorononane;hydrochloride?
1,9-difluorononane;hydrochloride has a molecular weight of 200.70 g/mol, XLogP of 4.08, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,9-difluorononane;hydrochloride is sourced from PubChem (CID 174355742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).