1-chlorononane

C9H19Cl — CID 17185

IUPAC1-chlorononane
SMILESCCCCCCCCCCl
InChIInChI=1S/C9H19Cl/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3
InChIKeyRKAMCQVGHFRILV-UHFFFAOYSA-N
MW162.70 g/mol
LogP3.98
Rot. Bonds7

About 1-chlorononane

1-chlorononane (PubChem CID 17185) has the molecular formula C9H19Cl and a molecular weight of 162.70 g/mol. Its IUPAC name is 1-chlorononane.

Molecular Properties

Compound Name1-chlorononane
PubChem CID17185
Molecular FormulaC9H19Cl
Molecular Weight162.70 g/mol
Exact Mass162.12
IUPAC Name1-chlorononane
SMILESCCCCCCCCCCl
InChIInChI=1S/C9H19Cl/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3
InChIKeyRKAMCQVGHFRILV-UHFFFAOYSA-N
XLogP3.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.70
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-chloropentadecane
CID 20996
1-chloropentane;tetracosane
CID 174427484
1-chloropentane;octacosane
CID 174937871
1-chloropentane;pentadecane
CID 174295582
CID 87162953
CID 87162953
sodium;1-chlorododecane;chloride
CID 175001889
azane;1-chlorohexadecane;hydrate
CID 174801150
1-chloroicosane;phosphane;dihydrochloride
CID 173449794
sodium;carbanide;1-chlorododecane
CID 175514406
1-chloropentane;ethane
CID 175284520
1-chlorohexane;N,N-dimethylmethanamine
CID 174391589
1-chloroicosane;dichlorophosphane
CID 173449796

Frequently Asked Questions

What is the IUPAC name of 1-chlorononane?
The IUPAC name of 1-chlorononane (CID 17185) is 1-chlorononane.
What is the SMILES notation for 1-chlorononane?
The canonical SMILES for 1-chlorononane is CCCCCCCCCCl.
What is the InChIKey of 1-chlorononane?
The InChIKey is RKAMCQVGHFRILV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19Cl/c1-2-3-4-5-6-7-8-9-10/h2-9H2,1H3.
What are the key properties of 1-chlorononane?
1-chlorononane has a molecular weight of 162.70 g/mol, XLogP of 3.98, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chlorononane is sourced from PubChem (CID 17185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).