arsagermene

C36H71AsGeSi2 — CID 101470640

IUPAC—
SMILESCC(C)(C)c1cc(C(C)(C)C)c([As]=[Ge])c(C(C)(C)C)c1.C[Si](C(C)(C)C)C(C)(C)C.C[Si](C(C)(C)C)C(C)(C)C
InChIInChI=1S/C18H29AsGe.2C9H21Si/c1-16(2,3)12-10-13(17(4,5)6)15(19-20)14(11-12)18(7,8)9;2*1-8(2,3)10(7)9(4,5)6/h10-11H,1-9H3;2*1-7H3
InChIKeyBWIQEMLABQIKCW-UHFFFAOYSA-N
MW707.67 g/mol
LogP11.41
Rot. Bonds1

About arsagermene

arsagermene (PubChem CID 101470640) has the molecular formula C36H71AsGeSi2 and a molecular weight of 707.67 g/mol.

Molecular Properties

Compound Namearsagermene
PubChem CID101470640
Molecular FormulaC36H71AsGeSi2
Molecular Weight707.67 g/mol
Exact Mass708.35
IUPAC Name—
SMILESCC(C)(C)c1cc(C(C)(C)C)c([As]=[Ge])c(C(C)(C)C)c1.C[Si](C(C)(C)C)C(C)(C)C.C[Si](C(C)(C)C)C(C)(C)C
InChIInChI=1S/C18H29AsGe.2C9H21Si/c1-16(2,3)12-10-13(17(4,5)6)15(19-20)14(11-12)18(7,8)9;2*1-8(2,3)10(7)9(4,5)6/h10-11H,1-9H3;2*1-7H3
InChIKeyBWIQEMLABQIKCW-UHFFFAOYSA-N
XLogP11.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500707.67
LogP ≤ 511.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of arsagermene?
The IUPAC name of arsagermene (CID 101470640) is not available.
What is the SMILES notation for arsagermene?
The canonical SMILES for arsagermene is CC(C)(C)c1cc(C(C)(C)C)c([As]=[Ge])c(C(C)(C)C)c1.C[Si](C(C)(C)C)C(C)(C)C.C[Si](C(C)(C)C)C(C)(C)C.
What is the InChIKey of arsagermene?
The InChIKey is BWIQEMLABQIKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29AsGe.2C9H21Si/c1-16(2,3)12-10-13(17(4,5)6)15(19-20)14(11-12)18(7,8)9;2*1-8(2,3)10(7)9(4,5)6/h10-11H,1-9H3;2*1-7H3.
What are the key properties of arsagermene?
arsagermene has a molecular weight of 707.67 g/mol, XLogP of 11.41, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for arsagermene is sourced from PubChem (CID 101470640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).