3-germylpropanoic acid

C6H16Ge2O4 — CID 174053696

IUPAC3-germylpropanoic acid
SMILESO=C(O)CC[GeH3].O=C(O)CC[GeH3]
InChIInChI=1S/2C3H8GeO2/c2*4-2-1-3(5)6/h2*1-2H2,4H3,(H,5,6)
InChIKeySXDTUVBJBNETHY-UHFFFAOYSA-N
MW297.41 g/mol
LogP-1.51
Rot. Bonds4

About 3-germylpropanoic acid

3-germylpropanoic acid (PubChem CID 174053696) has the molecular formula C6H16Ge2O4 and a molecular weight of 297.41 g/mol. Its IUPAC name is 3-germylpropanoic acid.

Molecular Properties

Compound Name3-germylpropanoic acid
PubChem CID174053696
Molecular FormulaC6H16Ge2O4
Molecular Weight297.41 g/mol
Exact Mass299.95
IUPAC Name3-germylpropanoic acid
SMILESO=C(O)CC[GeH3].O=C(O)CC[GeH3]
InChIInChI=1S/2C3H8GeO2/c2*4-2-1-3(5)6/h2*1-2H2,4H3,(H,5,6)
InChIKeySXDTUVBJBNETHY-UHFFFAOYSA-N
XLogP-1.51
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 5-1.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

bis(butanedioic acid);carbonic acid
CID 159577506
bis(butanedioic acid);silane
CID 173419629
butanedioic acid;hydrochloride
CID 87113713
trisodium;butanedioic acid
CID 175698490
azane;butanedioic acid
CID 87070561
bis(butanedioic acid);hydroxylamine
CID 174855273
azane;butanedioic acid;dihydrate
CID 141112137
butanedioic acid;ethene
CID 87532899
butanedioic acid;zinc;dihydrate
CID 175420905
butanedioic acid;zinc;dihydrate
CID 175091968
butanedioic acid;difluoromethane
CID 159584710
tridecanedioic acid;undecanedioic acid
CID 158333715

Frequently Asked Questions

What is the IUPAC name of 3-germylpropanoic acid?
The IUPAC name of 3-germylpropanoic acid (CID 174053696) is 3-germylpropanoic acid.
What is the SMILES notation for 3-germylpropanoic acid?
The canonical SMILES for 3-germylpropanoic acid is O=C(O)CC[GeH3].O=C(O)CC[GeH3].
What is the InChIKey of 3-germylpropanoic acid?
The InChIKey is SXDTUVBJBNETHY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H8GeO2/c2*4-2-1-3(5)6/h2*1-2H2,4H3,(H,5,6).
What are the key properties of 3-germylpropanoic acid?
3-germylpropanoic acid has a molecular weight of 297.41 g/mol, XLogP of -1.51, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-germylpropanoic acid is sourced from PubChem (CID 174053696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).