2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane

C26H62 — CID 157158834

IUPAC2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane
SMILESC.CCC(C)C.CCC(C)CC.CCCC(C)C.CCCC(C)C(C)C
InChIInChI=1S/C8H18.2C6H14.C5H12.CH4/c1-5-6-8(4)7(2)3;1-4-5-6(2)3;1-4-6(3)5-2;1-4-5(2)3;/h7-8H,5-6H2,1-4H3;2*6H,4-5H2,1-3H3;5H,4H2,1-3H3;1H4
InChIKeyAMDAXCDAVXUAJR-UHFFFAOYSA-N
MW374.78 g/mol
LogP10.65
Rot. Bonds8

About 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane

2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane (PubChem CID 157158834) has the molecular formula C26H62 and a molecular weight of 374.78 g/mol. Its IUPAC name is 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane.

Molecular Properties

Compound Name2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane
PubChem CID157158834
Molecular FormulaC26H62
Molecular Weight374.78 g/mol
Exact Mass374.49
IUPAC Name2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane
SMILESC.CCC(C)C.CCC(C)CC.CCCC(C)C.CCCC(C)C(C)C
InChIInChI=1S/C8H18.2C6H14.C5H12.CH4/c1-5-6-8(4)7(2)3;1-4-5-6(2)3;1-4-6(3)5-2;1-4-5(2)3;/h7-8H,5-6H2,1-4H3;2*6H,4-5H2,1-3H3;5H,4H2,1-3H3;1H4
InChIKeyAMDAXCDAVXUAJR-UHFFFAOYSA-N
XLogP10.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.78
LogP ≤ 510.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

bis(2,3-dimethylpentane);ethane;bis(2-methylbutane);bis(2-methylpentane)
CID 160533172
2,3-dimethylhexane;2,5-dimethylhexane;2-methylbutane;2-methylheptane;2-methylhexane;2-methyloctane;2-methylpentane
CID 161353303
methane;2-methylpentane;propane
CID 161026516
ethane;methane;bis(2-methylpentane)
CID 142143156
2-methylpentane
CID 7892
3-ethyl-2,4-dimethylpentane;methane;2-methylpentane
CID 158735959
3-methylheptane;2-methylpentane
CID 165405793
ethane;2-methylpentane
CID 143713716
2-methylpentane;hydroiodide
CID 160726714
azane;2-methylpentane
CID 18347292
azane;2-methylpentane
CID 87098569
methane;3-methylpentane
CID 157218592

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane?
The IUPAC name of 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane (CID 157158834) is 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane.
What is the SMILES notation for 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane?
The canonical SMILES for 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane is C.CCC(C)C.CCC(C)CC.CCCC(C)C.CCCC(C)C(C)C.
What is the InChIKey of 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane?
The InChIKey is AMDAXCDAVXUAJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18.2C6H14.C5H12.CH4/c1-5-6-8(4)7(2)3;1-4-5-6(2)3;1-4-6(3)5-2;1-4-5(2)3;/h7-8H,5-6H2,1-4H3;2*6H,4-5H2,1-3H3;5H,4H2,1-3H3;1H4.
What are the key properties of 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane?
2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane has a molecular weight of 374.78 g/mol, XLogP of 10.65, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylhexane;methane;2-methylbutane;2-methylpentane;3-methylpentane is sourced from PubChem (CID 157158834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).