CID 88509370

C29H46Ge2O — CID 88509370

IUPAC—
SMILESCCC[Ge](CCC)OC(CC[Ge](C(C)(C)C)C(C)(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C29H46Ge2O/c1-9-22-30(23-10-2)32-29(25-17-13-11-14-18-25,26-19-15-12-16-20-26)21-24-31(27(3,4)5)28(6,7)8/h11-20H,9-10,21-24H2,1-8H3
InChIKeySGMZKSSWKDUWBX-UHFFFAOYSA-N
MW555.91 g/mol
LogP9.24
Rot. Bonds11

About CID 88509370

CID 88509370 (PubChem CID 88509370) has the molecular formula C29H46Ge2O and a molecular weight of 555.91 g/mol.

Molecular Properties

Compound NameCID 88509370
PubChem CID88509370
Molecular FormulaC29H46Ge2O
Molecular Weight555.91 g/mol
Exact Mass558.20
IUPAC Name—
SMILESCCC[Ge](CCC)OC(CC[Ge](C(C)(C)C)C(C)(C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C29H46Ge2O/c1-9-22-30(23-10-2)32-29(25-17-13-11-14-18-25,26-19-15-12-16-20-26)21-24-31(27(3,4)5)28(6,7)8/h11-20H,9-10,21-24H2,1-8H3
InChIKeySGMZKSSWKDUWBX-UHFFFAOYSA-N
XLogP9.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500555.91
LogP ≤ 59.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 88509370?
The IUPAC name of CID 88509370 (CID 88509370) is not available.
What is the SMILES notation for CID 88509370?
The canonical SMILES for CID 88509370 is CCC[Ge](CCC)OC(CC[Ge](C(C)(C)C)C(C)(C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 88509370?
The InChIKey is SGMZKSSWKDUWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H46Ge2O/c1-9-22-30(23-10-2)32-29(25-17-13-11-14-18-25,26-19-15-12-16-20-26)21-24-31(27(3,4)5)28(6,7)8/h11-20H,9-10,21-24H2,1-8H3.
What are the key properties of CID 88509370?
CID 88509370 has a molecular weight of 555.91 g/mol, XLogP of 9.24, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 88509370 is sourced from PubChem (CID 88509370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).