CID 173451818

C3H8AlCl3 — CID 173451818

IUPAC—
SMILESC=CC[Al].Cl.Cl.Cl
InChIInChI=1S/C3H5.Al.3ClH/c1-3-2;;;;/h3H,1-2H2;;3*1H
InChIKeyJREJWJKHOSGGRH-UHFFFAOYSA-N
MW177.44 g/mol
LogP2.02
Rot. Bonds1

About CID 173451818

CID 173451818 (PubChem CID 173451818) has the molecular formula C3H8AlCl3 and a molecular weight of 177.44 g/mol.

Molecular Properties

Compound NameCID 173451818
PubChem CID173451818
Molecular FormulaC3H8AlCl3
Molecular Weight177.44 g/mol
Exact Mass175.95
IUPAC Name—
SMILESC=CC[Al].Cl.Cl.Cl
InChIInChI=1S/C3H5.Al.3ClH/c1-3-2;;;;/h3H,1-2H2;;3*1H
InChIKeyJREJWJKHOSGGRH-UHFFFAOYSA-N
XLogP2.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.44
LogP ≤ 52.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 173451818?
The IUPAC name of CID 173451818 (CID 173451818) is not available.
What is the SMILES notation for CID 173451818?
The canonical SMILES for CID 173451818 is C=CC[Al].Cl.Cl.Cl.
What is the InChIKey of CID 173451818?
The InChIKey is JREJWJKHOSGGRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5.Al.3ClH/c1-3-2;;;;/h3H,1-2H2;;3*1H.
What are the key properties of CID 173451818?
CID 173451818 has a molecular weight of 177.44 g/mol, XLogP of 2.02, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173451818 is sourced from PubChem (CID 173451818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).