CID 11724406

C12H15Cl2GeO2+ — CID 11724406

IUPAC—
SMILESC(=C/C1OCCC[OH+]1)\c1ccccc1.Cl[Ge]Cl
InChIInChI=1S/C12H14O2.Cl2Ge/c1-2-5-11(6-3-1)7-8-12-13-9-4-10-14-12;1-3-2/h1-3,5-8,12H,4,9-10H2;/p+1/b8-7+;
InChIKeyIWFVSLVYQLPLFK-USRGLUTNSA-O
MW334.77 g/mol
LogP2.97
Rot. Bonds2

About CID 11724406

CID 11724406 (PubChem CID 11724406) has the molecular formula C12H15Cl2GeO2+ and a molecular weight of 334.77 g/mol.

Molecular Properties

Compound NameCID 11724406
PubChem CID11724406
Molecular FormulaC12H15Cl2GeO2+
Molecular Weight334.77 g/mol
Exact Mass334.97
IUPAC Name—
SMILESC(=C/C1OCCC[OH+]1)\c1ccccc1.Cl[Ge]Cl
InChIInChI=1S/C12H14O2.Cl2Ge/c1-2-5-11(6-3-1)7-8-12-13-9-4-10-14-12;1-3-2/h1-3,5-8,12H,4,9-10H2;/p+1/b8-7+;
InChIKeyIWFVSLVYQLPLFK-USRGLUTNSA-O
XLogP2.97
TPSA22.03 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.77
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 11724406?
The IUPAC name of CID 11724406 (CID 11724406) is not available.
What is the SMILES notation for CID 11724406?
The canonical SMILES for CID 11724406 is C(=C/C1OCCC[OH+]1)\c1ccccc1.Cl[Ge]Cl.
What is the InChIKey of CID 11724406?
The InChIKey is IWFVSLVYQLPLFK-USRGLUTNSA-O. The full InChI is InChI=1S/C12H14O2.Cl2Ge/c1-2-5-11(6-3-1)7-8-12-13-9-4-10-14-12;1-3-2/h1-3,5-8,12H,4,9-10H2;/p+1/b8-7+;.
What are the key properties of CID 11724406?
CID 11724406 has a molecular weight of 334.77 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11724406 is sourced from PubChem (CID 11724406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).