acetic acid;3-methylbutylgermane

C7H18GeO2 — CID 175120417

IUPACacetic acid;3-methylbutylgermane
SMILESCC(=O)O.CC(C)CC[GeH3]
InChIInChI=1S/C5H14Ge.C2H4O2/c1-5(2)3-4-6;1-2(3)4/h5H,3-4H2,1-2,6H3;1H3,(H,3,4)
InChIKeySVKLFFMXBSRJHM-UHFFFAOYSA-N
MW206.83 g/mol
LogP0.91
Rot. Bonds2

About acetic acid;3-methylbutylgermane

acetic acid;3-methylbutylgermane (PubChem CID 175120417) has the molecular formula C7H18GeO2 and a molecular weight of 206.83 g/mol. Its IUPAC name is acetic acid;3-methylbutylgermane.

Molecular Properties

Compound Nameacetic acid;3-methylbutylgermane
PubChem CID175120417
Molecular FormulaC7H18GeO2
Molecular Weight206.83 g/mol
Exact Mass208.05
IUPAC Nameacetic acid;3-methylbutylgermane
SMILESCC(=O)O.CC(C)CC[GeH3]
InChIInChI=1S/C5H14Ge.C2H4O2/c1-5(2)3-4-6;1-2(3)4/h5H,3-4H2,1-2,6H3;1H3,(H,3,4)
InChIKeySVKLFFMXBSRJHM-UHFFFAOYSA-N
XLogP0.91
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.83
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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CID 6330375
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Frequently Asked Questions

What is the IUPAC name of acetic acid;3-methylbutylgermane?
The IUPAC name of acetic acid;3-methylbutylgermane (CID 175120417) is acetic acid;3-methylbutylgermane.
What is the SMILES notation for acetic acid;3-methylbutylgermane?
The canonical SMILES for acetic acid;3-methylbutylgermane is CC(=O)O.CC(C)CC[GeH3].
What is the InChIKey of acetic acid;3-methylbutylgermane?
The InChIKey is SVKLFFMXBSRJHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14Ge.C2H4O2/c1-5(2)3-4-6;1-2(3)4/h5H,3-4H2,1-2,6H3;1H3,(H,3,4).
What are the key properties of acetic acid;3-methylbutylgermane?
acetic acid;3-methylbutylgermane has a molecular weight of 206.83 g/mol, XLogP of 0.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;3-methylbutylgermane is sourced from PubChem (CID 175120417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).