CID 87072273

CH5AlCl2 — CID 87072273

IUPAC—
SMILESC[Al].Cl.Cl
InChIInChI=1S/CH3.Al.2ClH/h1H3;;2*1H
InChIKeyHNLJTTJRHOIYCD-UHFFFAOYSA-N
MW114.94 g/mol
LogP1.05
Rot. Bonds

About CID 87072273

CID 87072273 (PubChem CID 87072273) has the molecular formula CH5AlCl2 and a molecular weight of 114.94 g/mol.

Molecular Properties

Compound NameCID 87072273
PubChem CID87072273
Molecular FormulaCH5AlCl2
Molecular Weight114.94 g/mol
Exact Mass113.96
IUPAC Name—
SMILESC[Al].Cl.Cl
InChIInChI=1S/CH3.Al.2ClH/h1H3;;2*1H
InChIKeyHNLJTTJRHOIYCD-UHFFFAOYSA-N
XLogP1.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.94
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 87072273?
The IUPAC name of CID 87072273 (CID 87072273) is not available.
What is the SMILES notation for CID 87072273?
The canonical SMILES for CID 87072273 is C[Al].Cl.Cl.
What is the InChIKey of CID 87072273?
The InChIKey is HNLJTTJRHOIYCD-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3.Al.2ClH/h1H3;;2*1H.
What are the key properties of CID 87072273?
CID 87072273 has a molecular weight of 114.94 g/mol, XLogP of 1.05, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87072273 is sourced from PubChem (CID 87072273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).