CID 173268155

C20H44Al — CID 173268155

IUPAC—
SMILESCCCCCCCCCC[Al]CCCCCCCCCC.[H][H]
InChIInChI=1S/2C10H21.Al.H2/c2*1-3-5-7-9-10-8-6-4-2;;/h2*1,3-10H2,2H3;;1H
InChIKeyBOXHLTYVRHQYGX-UHFFFAOYSA-N
MW311.55 g/mol
LogP8.05
Rot. Bonds18

About CID 173268155

CID 173268155 (PubChem CID 173268155) has the molecular formula C20H44Al and a molecular weight of 311.55 g/mol.

Molecular Properties

Compound NameCID 173268155
PubChem CID173268155
Molecular FormulaC20H44Al
Molecular Weight311.55 g/mol
Exact Mass311.33
IUPAC Name—
SMILESCCCCCCCCCC[Al]CCCCCCCCCC.[H][H]
InChIInChI=1S/2C10H21.Al.H2/c2*1-3-5-7-9-10-8-6-4-2;;/h2*1,3-10H2,2H3;;1H
InChIKeyBOXHLTYVRHQYGX-UHFFFAOYSA-N
XLogP8.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds18
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.55
LogP ≤ 58.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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ethane;octadecane
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CID 159790875
ethane;heptane;methane
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ethane;methane;octane
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butane;ethane;heptane
CID 143121250
ethane;tris(heptane);propane
CID 158842848
azane;hexane;molecular hydrogen
CID 143167531
ethane;methane;tridecane
CID 159295261
ethane;heptane;pentane
CID 142269041
CID 161246447
CID 161246447
dohexacontane
CID 522644

Frequently Asked Questions

What is the IUPAC name of CID 173268155?
The IUPAC name of CID 173268155 (CID 173268155) is not available.
What is the SMILES notation for CID 173268155?
The canonical SMILES for CID 173268155 is CCCCCCCCCC[Al]CCCCCCCCCC.[H][H].
What is the InChIKey of CID 173268155?
The InChIKey is BOXHLTYVRHQYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H21.Al.H2/c2*1-3-5-7-9-10-8-6-4-2;;/h2*1,3-10H2,2H3;;1H.
What are the key properties of CID 173268155?
CID 173268155 has a molecular weight of 311.55 g/mol, XLogP of 8.05, 18 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173268155 is sourced from PubChem (CID 173268155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).