2-methylnonane;heptahydrofluoride

C10H29F7 — CID 160801749

IUPAC2-methylnonane;heptahydrofluoride
SMILESCCCCCCCC(C)C.F.F.F.F.F.F.F
InChIInChI=1S/C10H22.7FH/c1-4-5-6-7-8-9-10(2)3;;;;;;;/h10H,4-9H2,1-3H3;7*1H
InChIKeyXUTWGRCLVUEEAL-UHFFFAOYSA-N
MW282.33 g/mol
LogP5.07
Rot. Bonds6

About 2-methylnonane;heptahydrofluoride

2-methylnonane;heptahydrofluoride (PubChem CID 160801749) has the molecular formula C10H29F7 and a molecular weight of 282.33 g/mol. Its IUPAC name is 2-methylnonane;heptahydrofluoride.

Molecular Properties

Compound Name2-methylnonane;heptahydrofluoride
PubChem CID160801749
Molecular FormulaC10H29F7
Molecular Weight282.33 g/mol
Exact Mass282.22
IUPAC Name2-methylnonane;heptahydrofluoride
SMILESCCCCCCCC(C)C.F.F.F.F.F.F.F
InChIInChI=1S/C10H22.7FH/c1-4-5-6-7-8-9-10(2)3;;;;;;;/h10H,4-9H2,1-3H3;7*1H
InChIKeyXUTWGRCLVUEEAL-UHFFFAOYSA-N
XLogP5.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.33
LogP ≤ 55.07
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

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CID 90745672
2-methyldecane
CID 23415
2-methyltetratriacontane
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CID 519147
alumane;2-methyldecane
CID 174844655
azane;2-methyloctadecane
CID 175414560
methane;2-methylicosane
CID 157337652
2-methyltricosane;hydrate
CID 172783998
2-methylheptadecane;hydrobromide
CID 174866228
2-methylbutane;2-methyltridecane
CID 54106775
ethane;2-methyloctane;pentane
CID 144527652
mercury;2-methylheptane
CID 175108338

Frequently Asked Questions

What is the IUPAC name of 2-methylnonane;heptahydrofluoride?
The IUPAC name of 2-methylnonane;heptahydrofluoride (CID 160801749) is 2-methylnonane;heptahydrofluoride.
What is the SMILES notation for 2-methylnonane;heptahydrofluoride?
The canonical SMILES for 2-methylnonane;heptahydrofluoride is CCCCCCCC(C)C.F.F.F.F.F.F.F.
What is the InChIKey of 2-methylnonane;heptahydrofluoride?
The InChIKey is XUTWGRCLVUEEAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22.7FH/c1-4-5-6-7-8-9-10(2)3;;;;;;;/h10H,4-9H2,1-3H3;7*1H.
What are the key properties of 2-methylnonane;heptahydrofluoride?
2-methylnonane;heptahydrofluoride has a molecular weight of 282.33 g/mol, XLogP of 5.07, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylnonane;heptahydrofluoride is sourced from PubChem (CID 160801749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).