2-butyl-2-methyloxane

C10H20O — CID 13494550

IUPAC2-butyl-2-methyloxane
SMILESCCCCC1(C)CCCCO1
InChIInChI=1S/C10H20O/c1-3-4-7-10(2)8-5-6-9-11-10/h3-9H2,1-2H3
InChIKeyHTOJEMCKDBQEOZ-UHFFFAOYSA-N
MW156.27 g/mol
LogP3.14
Rot. Bonds3

About 2-butyl-2-methyloxane

2-butyl-2-methyloxane (PubChem CID 13494550) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-butyl-2-methyloxane.

Molecular Properties

Compound Name2-butyl-2-methyloxane
PubChem CID13494550
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-butyl-2-methyloxane
SMILESCCCCC1(C)CCCCO1
InChIInChI=1S/C10H20O/c1-3-4-7-10(2)8-5-6-9-11-10/h3-9H2,1-2H3
InChIKeyHTOJEMCKDBQEOZ-UHFFFAOYSA-N
XLogP3.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-hexyl-2-methyloxane
CID 67835603
2-heptyl-2-methyloxolane
CID 66630336
(2-butyloxan-2-yl)-dimethylsilane
CID 123761011
2-pentyloxan-2-ol
CID 10035063
1-butyl-1-(1-butylcyclohexyl)cyclohexane
CID 173069670
(2-hexyloxan-2-yl)silane
CID 123313847
2-heptyl-2-(2-heptyloxan-2-yl)oxyoxane
CID 141006538
2-(2-methyloxan-2-yl)acetaldehyde
CID 165478002
N,N-dimethyl-2-(2-methyloxolan-2-yl)ethanamine
CID 163403570
(2S)-2-methyl-2-[2-[(2R)-2-methyloxolan-2-yl]ethyl]hexan-1-imine
CID 170367393
2-dodecyl-2-methylmorpholine;hydrobromide
CID 173402578
butyl-(2-ethyloxan-2-yl)silane
CID 174787335

Frequently Asked Questions

What is the IUPAC name of 2-butyl-2-methyloxane?
The IUPAC name of 2-butyl-2-methyloxane (CID 13494550) is 2-butyl-2-methyloxane.
What is the SMILES notation for 2-butyl-2-methyloxane?
The canonical SMILES for 2-butyl-2-methyloxane is CCCCC1(C)CCCCO1.
What is the InChIKey of 2-butyl-2-methyloxane?
The InChIKey is HTOJEMCKDBQEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-4-7-10(2)8-5-6-9-11-10/h3-9H2,1-2H3.
What are the key properties of 2-butyl-2-methyloxane?
2-butyl-2-methyloxane has a molecular weight of 156.27 g/mol, XLogP of 3.14, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-2-methyloxane is sourced from PubChem (CID 13494550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).