2,2,4,5-tetramethylhexane

C10H22 — CID 28029

IUPAC2,2,4,5-tetramethylhexane
SMILESCC(C)C(C)CC(C)(C)C
InChIInChI=1S/C10H22/c1-8(2)9(3)7-10(4,5)6/h8-9H,7H2,1-6H3
InChIKeyKDRZICOOQNIJDN-UHFFFAOYSA-N
MW142.29 g/mol
LogP3.71
Rot. Bonds2

About 2,2,4,5-tetramethylhexane

2,2,4,5-tetramethylhexane (PubChem CID 28029) has the molecular formula C10H22 and a molecular weight of 142.29 g/mol. Its IUPAC name is 2,2,4,5-tetramethylhexane.

Molecular Properties

Compound Name2,2,4,5-tetramethylhexane
PubChem CID28029
Molecular FormulaC10H22
Molecular Weight142.29 g/mol
Exact Mass142.17
IUPAC Name2,2,4,5-tetramethylhexane
SMILESCC(C)C(C)CC(C)(C)C
InChIInChI=1S/C10H22/c1-8(2)9(3)7-10(4,5)6/h8-9H,7H2,1-6H3
InChIKeyKDRZICOOQNIJDN-UHFFFAOYSA-N
XLogP3.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.29
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,2,4-Trimethylpentane
CID 10907
2,2-Dimethylhexane
CID 11551
2,4-Dimethylhexane
CID 11511
2,3,4-Trimethylpentane
CID 11269
3,4-Dimethylheptane
CID 13534
2,3,3-Trimethylpentane
CID 11215
3,3-Dimethylhexane
CID 11233
3,4-Dimethylhexane
CID 11412
2,3-Dimethylhexane
CID 11447
3-Ethyl-2-methylpentane
CID 11863
2,3,4-Trimethylhexane
CID 13533
2,2,4-Trimethylheptane
CID 26839

Frequently Asked Questions

What is the IUPAC name of 2,2,4,5-tetramethylhexane?
The IUPAC name of 2,2,4,5-tetramethylhexane (CID 28029) is 2,2,4,5-tetramethylhexane.
What is the SMILES notation for 2,2,4,5-tetramethylhexane?
The canonical SMILES for 2,2,4,5-tetramethylhexane is CC(C)C(C)CC(C)(C)C.
What is the InChIKey of 2,2,4,5-tetramethylhexane?
The InChIKey is KDRZICOOQNIJDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22/c1-8(2)9(3)7-10(4,5)6/h8-9H,7H2,1-6H3.
What are the key properties of 2,2,4,5-tetramethylhexane?
2,2,4,5-tetramethylhexane has a molecular weight of 142.29 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,5-tetramethylhexane is sourced from PubChem (CID 28029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).