(Z)-2-fluoronon-2-enenitrile

C9H14FN — CID 11400896

IUPAC(Z)-2-fluoronon-2-enenitrile
SMILESCCCCCC/C=C(\F)C#N
InChIInChI=1S/C9H14FN/c1-2-3-4-5-6-7-9(10)8-11/h7H,2-6H2,1H3/b9-7-
InChIKeyALPIRDUKLFXXKJ-CLFYSBASSA-N
MW155.22 g/mol
LogP3.33
Rot. Bonds5

About (Z)-2-fluoronon-2-enenitrile

(Z)-2-fluoronon-2-enenitrile (PubChem CID 11400896) has the molecular formula C9H14FN and a molecular weight of 155.22 g/mol. Its IUPAC name is (Z)-2-fluoronon-2-enenitrile.

Molecular Properties

Compound Name(Z)-2-fluoronon-2-enenitrile
PubChem CID11400896
Molecular FormulaC9H14FN
Molecular Weight155.22 g/mol
Exact Mass155.11
IUPAC Name(Z)-2-fluoronon-2-enenitrile
SMILESCCCCCC/C=C(\F)C#N
InChIInChI=1S/C9H14FN/c1-2-3-4-5-6-7-9(10)8-11/h7H,2-6H2,1H3/b9-7-
InChIKeyALPIRDUKLFXXKJ-CLFYSBASSA-N
XLogP3.33
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.22
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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(Z)-2-trimethylsilylnon-2-enenitrile
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[(Z)-1-fluoronon-1-enyl]cyclopropane
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(Z)-2-fluorohexadec-2-en-1-amine;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of (Z)-2-fluoronon-2-enenitrile?
The IUPAC name of (Z)-2-fluoronon-2-enenitrile (CID 11400896) is (Z)-2-fluoronon-2-enenitrile.
What is the SMILES notation for (Z)-2-fluoronon-2-enenitrile?
The canonical SMILES for (Z)-2-fluoronon-2-enenitrile is CCCCCC/C=C(\F)C#N.
What is the InChIKey of (Z)-2-fluoronon-2-enenitrile?
The InChIKey is ALPIRDUKLFXXKJ-CLFYSBASSA-N. The full InChI is InChI=1S/C9H14FN/c1-2-3-4-5-6-7-9(10)8-11/h7H,2-6H2,1H3/b9-7-.
What are the key properties of (Z)-2-fluoronon-2-enenitrile?
(Z)-2-fluoronon-2-enenitrile has a molecular weight of 155.22 g/mol, XLogP of 3.33, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-fluoronon-2-enenitrile is sourced from PubChem (CID 11400896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).