1,1-difluorohexylarsane

C6H13AsF2 — CID 173206218

IUPAC1,1-difluorohexylarsane
SMILESCCCCCC(F)(F)[AsH2]
InChIInChI=1S/C6H13AsF2/c1-2-3-4-5-6(7,8)9/h2-5,7H2,1H3
InChIKeyBGEJHFHHVDFBLY-UHFFFAOYSA-N
MW198.09 g/mol
LogP1.79
Rot. Bonds4

About 1,1-difluorohexylarsane

1,1-difluorohexylarsane (PubChem CID 173206218) has the molecular formula C6H13AsF2 and a molecular weight of 198.09 g/mol. Its IUPAC name is 1,1-difluorohexylarsane.

Molecular Properties

Compound Name1,1-difluorohexylarsane
PubChem CID173206218
Molecular FormulaC6H13AsF2
Molecular Weight198.09 g/mol
Exact Mass198.02
IUPAC Name1,1-difluorohexylarsane
SMILESCCCCCC(F)(F)[AsH2]
InChIInChI=1S/C6H13AsF2/c1-2-3-4-5-6(7,8)9/h2-5,7H2,1H3
InChIKeyBGEJHFHHVDFBLY-UHFFFAOYSA-N
XLogP1.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.09
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 15685316
6-butyl-6-fluoroundecane
CID 11424735
3,3-difluorooctane
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1,1-dibromo-1-fluorohexane
CID 139643028
9-fluoropentacosan-9-ol
CID 139794548
1,1,1-trifluoro-2,2-dimethylheptane
CID 139399706
1,1,1,2,2-pentafluorononadecane
CID 98452406
hexane;molybdenum
CID 162092649
6,6-dipentylundecane
CID 19690398
1,1,1,7,7-pentafluoroheptadecane
CID 54180623
9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16-hexadecafluorohexacosane
CID 89419205
10,10-diiodononadecane
CID 154405241

Frequently Asked Questions

What is the IUPAC name of 1,1-difluorohexylarsane?
The IUPAC name of 1,1-difluorohexylarsane (CID 173206218) is 1,1-difluorohexylarsane.
What is the SMILES notation for 1,1-difluorohexylarsane?
The canonical SMILES for 1,1-difluorohexylarsane is CCCCCC(F)(F)[AsH2].
What is the InChIKey of 1,1-difluorohexylarsane?
The InChIKey is BGEJHFHHVDFBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13AsF2/c1-2-3-4-5-6(7,8)9/h2-5,7H2,1H3.
What are the key properties of 1,1-difluorohexylarsane?
1,1-difluorohexylarsane has a molecular weight of 198.09 g/mol, XLogP of 1.79, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluorohexylarsane is sourced from PubChem (CID 173206218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).