chloro-bis(2-methylpropyl)gallane

C8H18ClGa — CID 23270437

IUPACchloro-bis(2-methylpropyl)gallane
SMILESCC(C)C[Ga](Cl)CC(C)C
InChIInChI=1S/2C4H9.ClH.Ga/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;1H;/q;;;+1/p-1
InChIKeyLLIVPSXFROKNFC-UHFFFAOYSA-M
MW219.41 g/mol
LogP3.53
Rot. Bonds4

About chloro-bis(2-methylpropyl)gallane

chloro-bis(2-methylpropyl)gallane (PubChem CID 23270437) has the molecular formula C8H18ClGa and a molecular weight of 219.41 g/mol. Its IUPAC name is chloro-bis(2-methylpropyl)gallane.

Molecular Properties

Compound Namechloro-bis(2-methylpropyl)gallane
PubChem CID23270437
Molecular FormulaC8H18ClGa
Molecular Weight219.41 g/mol
Exact Mass218.04
IUPAC Namechloro-bis(2-methylpropyl)gallane
SMILESCC(C)C[Ga](Cl)CC(C)C
InChIInChI=1S/2C4H9.ClH.Ga/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;1H;/q;;;+1/p-1
InChIKeyLLIVPSXFROKNFC-UHFFFAOYSA-M
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.41
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of chloro-bis(2-methylpropyl)gallane?
The IUPAC name of chloro-bis(2-methylpropyl)gallane (CID 23270437) is chloro-bis(2-methylpropyl)gallane.
What is the SMILES notation for chloro-bis(2-methylpropyl)gallane?
The canonical SMILES for chloro-bis(2-methylpropyl)gallane is CC(C)C[Ga](Cl)CC(C)C.
What is the InChIKey of chloro-bis(2-methylpropyl)gallane?
The InChIKey is LLIVPSXFROKNFC-UHFFFAOYSA-M. The full InChI is InChI=1S/2C4H9.ClH.Ga/c2*1-4(2)3;;/h2*4H,1H2,2-3H3;1H;/q;;;+1/p-1.
What are the key properties of chloro-bis(2-methylpropyl)gallane?
chloro-bis(2-methylpropyl)gallane has a molecular weight of 219.41 g/mol, XLogP of 3.53, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-bis(2-methylpropyl)gallane is sourced from PubChem (CID 23270437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).