chloromethyl(dimethyl)alumane

C3H8AlCl — CID 170946047

IUPACchloromethyl(dimethyl)alumane
SMILESC[Al](C)CCl
InChIInChI=1S/CH2Cl.2CH3.Al/c1-2;;;/h1H2;2*1H3;
InChIKeyJRXGJKGICHPNLI-UHFFFAOYSA-N
MW106.53 g/mol
LogP1.52
Rot. Bonds1

About chloromethyl(dimethyl)alumane

chloromethyl(dimethyl)alumane (PubChem CID 170946047) has the molecular formula C3H8AlCl and a molecular weight of 106.53 g/mol. Its IUPAC name is chloromethyl(dimethyl)alumane.

Molecular Properties

Compound Namechloromethyl(dimethyl)alumane
PubChem CID170946047
Molecular FormulaC3H8AlCl
Molecular Weight106.53 g/mol
Exact Mass106.01
IUPAC Namechloromethyl(dimethyl)alumane
SMILESC[Al](C)CCl
InChIInChI=1S/CH2Cl.2CH3.Al/c1-2;;;/h1H2;2*1H3;
InChIKeyJRXGJKGICHPNLI-UHFFFAOYSA-N
XLogP1.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500106.53
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 90725364

Frequently Asked Questions

What is the IUPAC name of chloromethyl(dimethyl)alumane?
The IUPAC name of chloromethyl(dimethyl)alumane (CID 170946047) is chloromethyl(dimethyl)alumane.
What is the SMILES notation for chloromethyl(dimethyl)alumane?
The canonical SMILES for chloromethyl(dimethyl)alumane is C[Al](C)CCl.
What is the InChIKey of chloromethyl(dimethyl)alumane?
The InChIKey is JRXGJKGICHPNLI-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2Cl.2CH3.Al/c1-2;;;/h1H2;2*1H3;.
What are the key properties of chloromethyl(dimethyl)alumane?
chloromethyl(dimethyl)alumane has a molecular weight of 106.53 g/mol, XLogP of 1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl(dimethyl)alumane is sourced from PubChem (CID 170946047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).