CID 173074269

C48H60Ge4 — CID 173074269

IUPAC—
SMILESCC[Ge](CC)CC.CC[Ge](CC)CC.c1ccc([Ge](c2ccccc2)c2ccccc2)cc1.c1ccc([Ge](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15Ge.2C6H15Ge/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-4-7(5-2)6-3/h2*1-15H;2*4-6H2,1-3H3
InChIKeyNKQRUQBWVCKSEA-UHFFFAOYSA-N
MW927.45 g/mol
LogP9.49
Rot. Bonds12

About CID 173074269

CID 173074269 (PubChem CID 173074269) has the molecular formula C48H60Ge4 and a molecular weight of 927.45 g/mol.

Molecular Properties

Compound NameCID 173074269
PubChem CID173074269
Molecular FormulaC48H60Ge4
Molecular Weight927.45 g/mol
Exact Mass932.15
IUPAC Name—
SMILESCC[Ge](CC)CC.CC[Ge](CC)CC.c1ccc([Ge](c2ccccc2)c2ccccc2)cc1.c1ccc([Ge](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H15Ge.2C6H15Ge/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-4-7(5-2)6-3/h2*1-15H;2*4-6H2,1-3H3
InChIKeyNKQRUQBWVCKSEA-UHFFFAOYSA-N
XLogP9.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500927.45
LogP ≤ 59.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 173074269?
The IUPAC name of CID 173074269 (CID 173074269) is not available.
What is the SMILES notation for CID 173074269?
The canonical SMILES for CID 173074269 is CC[Ge](CC)CC.CC[Ge](CC)CC.c1ccc([Ge](c2ccccc2)c2ccccc2)cc1.c1ccc([Ge](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of CID 173074269?
The InChIKey is NKQRUQBWVCKSEA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H15Ge.2C6H15Ge/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-4-7(5-2)6-3/h2*1-15H;2*4-6H2,1-3H3.
What are the key properties of CID 173074269?
CID 173074269 has a molecular weight of 927.45 g/mol, XLogP of 9.49, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173074269 is sourced from PubChem (CID 173074269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).