2-(fluoromethyl)oxaluminane

C5H10AlFO — CID 87808943

IUPAC2-(fluoromethyl)oxaluminane
SMILESFC[Al]1CCCCO1
InChIInChI=1S/C4H8O.CH2F.Al/c1-2-3-4-5;1-2;/h1-4H2;1H2;/q-1;;+1
InChIKeyZBPNHYUHMJFZEL-UHFFFAOYSA-N
MW132.11 g/mol
LogP1.30
Rot. Bonds1

About 2-(fluoromethyl)oxaluminane

2-(fluoromethyl)oxaluminane (PubChem CID 87808943) has the molecular formula C5H10AlFO and a molecular weight of 132.11 g/mol. Its IUPAC name is 2-(fluoromethyl)oxaluminane.

Molecular Properties

Compound Name2-(fluoromethyl)oxaluminane
PubChem CID87808943
Molecular FormulaC5H10AlFO
Molecular Weight132.11 g/mol
Exact Mass132.05
IUPAC Name2-(fluoromethyl)oxaluminane
SMILESFC[Al]1CCCCO1
InChIInChI=1S/C4H8O.CH2F.Al/c1-2-3-4-5;1-2;/h1-4H2;1H2;/q-1;;+1
InChIKeyZBPNHYUHMJFZEL-UHFFFAOYSA-N
XLogP1.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.11
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Ethylaluminoxane
CID 23260925
Methylalumoxane
CID 23511181
CID 59076056
CID 59076056
2-Fluorooxaluminane
CID 87257411
2-(1-Fluoroethyl)oxaluminane
CID 87811102
6-Fluoro-2-propyloxaluminane
CID 143389178
2-Butyl-6-fluorooxaluminane
CID 143389186
2-(1-Fluorobutyl)oxaluminane
CID 173627985
2-Ethyl-6-fluorooxaluminane
CID 174515494
2-Propan-2-yloxaluminane
CID 87071972
2-Propyloxaluminane
CID 87110729
2-Bromooxaluminane
CID 87257383

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)oxaluminane?
The IUPAC name of 2-(fluoromethyl)oxaluminane (CID 87808943) is 2-(fluoromethyl)oxaluminane.
What is the SMILES notation for 2-(fluoromethyl)oxaluminane?
The canonical SMILES for 2-(fluoromethyl)oxaluminane is FC[Al]1CCCCO1.
What is the InChIKey of 2-(fluoromethyl)oxaluminane?
The InChIKey is ZBPNHYUHMJFZEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O.CH2F.Al/c1-2-3-4-5;1-2;/h1-4H2;1H2;/q-1;;+1.
What are the key properties of 2-(fluoromethyl)oxaluminane?
2-(fluoromethyl)oxaluminane has a molecular weight of 132.11 g/mol, XLogP of 1.30, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)oxaluminane is sourced from PubChem (CID 87808943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).