3-methyl-3-trichlorogermylbutanoyl chloride

C5H8Cl4GeO — CID 13249037

IUPAC3-methyl-3-trichlorogermylbutanoyl chloride
SMILESCC(C)(CC(=O)Cl)[Ge](Cl)(Cl)Cl
InChIInChI=1S/C5H8Cl4GeO/c1-5(2,3-4(6)11)10(7,8)9/h3H2,1-2H3
InChIKeyJNIXNNXDXAFMPQ-UHFFFAOYSA-N
MW298.54 g/mol
LogP3.58
Rot. Bonds3

About 3-methyl-3-trichlorogermylbutanoyl chloride

3-methyl-3-trichlorogermylbutanoyl chloride (PubChem CID 13249037) has the molecular formula C5H8Cl4GeO and a molecular weight of 298.54 g/mol. Its IUPAC name is 3-methyl-3-trichlorogermylbutanoyl chloride.

Molecular Properties

Compound Name3-methyl-3-trichlorogermylbutanoyl chloride
PubChem CID13249037
Molecular FormulaC5H8Cl4GeO
Molecular Weight298.54 g/mol
Exact Mass297.85
IUPAC Name3-methyl-3-trichlorogermylbutanoyl chloride
SMILESCC(C)(CC(=O)Cl)[Ge](Cl)(Cl)Cl
InChIInChI=1S/C5H8Cl4GeO/c1-5(2,3-4(6)11)10(7,8)9/h3H2,1-2H3
InChIKeyJNIXNNXDXAFMPQ-UHFFFAOYSA-N
XLogP3.58
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.54
LogP ≤ 53.58
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 3-methyl-3-trichlorogermylbutanoyl chloride?
The IUPAC name of 3-methyl-3-trichlorogermylbutanoyl chloride (CID 13249037) is 3-methyl-3-trichlorogermylbutanoyl chloride.
What is the SMILES notation for 3-methyl-3-trichlorogermylbutanoyl chloride?
The canonical SMILES for 3-methyl-3-trichlorogermylbutanoyl chloride is CC(C)(CC(=O)Cl)[Ge](Cl)(Cl)Cl.
What is the InChIKey of 3-methyl-3-trichlorogermylbutanoyl chloride?
The InChIKey is JNIXNNXDXAFMPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8Cl4GeO/c1-5(2,3-4(6)11)10(7,8)9/h3H2,1-2H3.
What are the key properties of 3-methyl-3-trichlorogermylbutanoyl chloride?
3-methyl-3-trichlorogermylbutanoyl chloride has a molecular weight of 298.54 g/mol, XLogP of 3.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-trichlorogermylbutanoyl chloride is sourced from PubChem (CID 13249037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).