CID 102102281

C66H82Ge6 — CID 102102281

IUPAC—
SMILESCC(C)[Ge](C(C)C)C(C)C.CC(C)[Ge](C(C)C)C(C)C.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1
InChIInChI=1S/4C12H10Ge.2C9H21Ge/c4*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2*1-7(2)10(8(3)4)9(5)6/h4*1-10H;2*7-9H,1-6H3
InChIKeyXEQSCDRPNQWZML-UHFFFAOYSA-N
MW1311.04 g/mol
LogP12.79
Rot. Bonds14

About CID 102102281

CID 102102281 (PubChem CID 102102281) has the molecular formula C66H82Ge6 and a molecular weight of 1311.04 g/mol.

Molecular Properties

Compound NameCID 102102281
PubChem CID102102281
Molecular FormulaC66H82Ge6
Molecular Weight1311.04 g/mol
Exact Mass1318.17
IUPAC Name—
SMILESCC(C)[Ge](C(C)C)C(C)C.CC(C)[Ge](C(C)C)C(C)C.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1
InChIInChI=1S/4C12H10Ge.2C9H21Ge/c4*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2*1-7(2)10(8(3)4)9(5)6/h4*1-10H;2*7-9H,1-6H3
InChIKeyXEQSCDRPNQWZML-UHFFFAOYSA-N
XLogP12.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001311.04
LogP ≤ 512.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 102102281?
The IUPAC name of CID 102102281 (CID 102102281) is not available.
What is the SMILES notation for CID 102102281?
The canonical SMILES for CID 102102281 is CC(C)[Ge](C(C)C)C(C)C.CC(C)[Ge](C(C)C)C(C)C.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.c1ccc([Ge]c2ccccc2)cc1.
What is the InChIKey of CID 102102281?
The InChIKey is XEQSCDRPNQWZML-UHFFFAOYSA-N. The full InChI is InChI=1S/4C12H10Ge.2C9H21Ge/c4*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2*1-7(2)10(8(3)4)9(5)6/h4*1-10H;2*7-9H,1-6H3.
What are the key properties of CID 102102281?
CID 102102281 has a molecular weight of 1311.04 g/mol, XLogP of 12.79, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102102281 is sourced from PubChem (CID 102102281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).