2-trichlorogermylbutanoyl chloride

C4H6Cl4GeO — CID 87735949

IUPAC2-trichlorogermylbutanoyl chloride
SMILESCCC(C(=O)Cl)[Ge](Cl)(Cl)Cl
InChIInChI=1S/C4H6Cl4GeO/c1-2-3(4(5)10)9(6,7)8/h3H,2H2,1H3
InChIKeyPJXGSNKRKNHSRY-UHFFFAOYSA-N
MW284.51 g/mol
LogP3.19
Rot. Bonds3

About 2-trichlorogermylbutanoyl chloride

2-trichlorogermylbutanoyl chloride (PubChem CID 87735949) has the molecular formula C4H6Cl4GeO and a molecular weight of 284.51 g/mol. Its IUPAC name is 2-trichlorogermylbutanoyl chloride.

Molecular Properties

Compound Name2-trichlorogermylbutanoyl chloride
PubChem CID87735949
Molecular FormulaC4H6Cl4GeO
Molecular Weight284.51 g/mol
Exact Mass283.84
IUPAC Name2-trichlorogermylbutanoyl chloride
SMILESCCC(C(=O)Cl)[Ge](Cl)(Cl)Cl
InChIInChI=1S/C4H6Cl4GeO/c1-2-3(4(5)10)9(6,7)8/h3H,2H2,1H3
InChIKeyPJXGSNKRKNHSRY-UHFFFAOYSA-N
XLogP3.19
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.51
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-trichlorogermylbutanoyl chloride?
The IUPAC name of 2-trichlorogermylbutanoyl chloride (CID 87735949) is 2-trichlorogermylbutanoyl chloride.
What is the SMILES notation for 2-trichlorogermylbutanoyl chloride?
The canonical SMILES for 2-trichlorogermylbutanoyl chloride is CCC(C(=O)Cl)[Ge](Cl)(Cl)Cl.
What is the InChIKey of 2-trichlorogermylbutanoyl chloride?
The InChIKey is PJXGSNKRKNHSRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6Cl4GeO/c1-2-3(4(5)10)9(6,7)8/h3H,2H2,1H3.
What are the key properties of 2-trichlorogermylbutanoyl chloride?
2-trichlorogermylbutanoyl chloride has a molecular weight of 284.51 g/mol, XLogP of 3.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trichlorogermylbutanoyl chloride is sourced from PubChem (CID 87735949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).