2,2-bis(methoxymethyl)butylcyclobutane

C12H24O2 — CID 141250149

IUPAC2,2-bis(methoxymethyl)butylcyclobutane
SMILESCCC(COC)(COC)CC1CCC1
InChIInChI=1S/C12H24O2/c1-4-12(9-13-2,10-14-3)8-11-6-5-7-11/h11H,4-10H2,1-3H3
InChIKeyMXOVSDHDLNVTCO-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.87
Rot. Bonds7

About 2,2-bis(methoxymethyl)butylcyclobutane

2,2-bis(methoxymethyl)butylcyclobutane (PubChem CID 141250149) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 2,2-bis(methoxymethyl)butylcyclobutane.

Molecular Properties

Compound Name2,2-bis(methoxymethyl)butylcyclobutane
PubChem CID141250149
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name2,2-bis(methoxymethyl)butylcyclobutane
SMILESCCC(COC)(COC)CC1CCC1
InChIInChI=1S/C12H24O2/c1-4-12(9-13-2,10-14-3)8-11-6-5-7-11/h11H,4-10H2,1-3H3
InChIKeyMXOVSDHDLNVTCO-UHFFFAOYSA-N
XLogP2.87
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[2,2-bis(methoxymethyl)-4-methylpentyl]cyclobutane
CID 141250115
2-(cyclopentylmethyl)-2-ethylbutan-1-ol
CID 66058711
2-(cyclopentylmethyl)-2-ethylpropane-1,3-diol
CID 79449950
2,2-dimethylpropane;2,2-dimethylpropylcyclobutane
CID 167591215
2-(cyclopropylmethyl)-2-ethyl-N,N-dimethylbutan-1-amine
CID 126698955
(2-ethyl-2,3-dimethylbutyl)cyclobutane
CID 123708911
[1-cyclobutyl-2-(cyclopropylmethyl)butan-2-yl]cyclopentane
CID 54340340
1-methoxy-2,2-bis[(2-methylpropan-2-yl)oxymethyl]butane
CID 171725386
1-methoxy-2-(methoxymethyl)-2-[(2-methylpropan-2-yl)oxymethyl]butane
CID 86682667
2-(cyclohexylmethyl)-2-ethyl-N-methylhexan-1-amine
CID 55194903
2,2-bis(chloromethyl)pentylcyclopentane
CID 79447124
2-ethyl-2-(oxan-4-ylmethyl)propane-1,3-diol
CID 79450037

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(methoxymethyl)butylcyclobutane?
The IUPAC name of 2,2-bis(methoxymethyl)butylcyclobutane (CID 141250149) is 2,2-bis(methoxymethyl)butylcyclobutane.
What is the SMILES notation for 2,2-bis(methoxymethyl)butylcyclobutane?
The canonical SMILES for 2,2-bis(methoxymethyl)butylcyclobutane is CCC(COC)(COC)CC1CCC1.
What is the InChIKey of 2,2-bis(methoxymethyl)butylcyclobutane?
The InChIKey is MXOVSDHDLNVTCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-4-12(9-13-2,10-14-3)8-11-6-5-7-11/h11H,4-10H2,1-3H3.
What are the key properties of 2,2-bis(methoxymethyl)butylcyclobutane?
2,2-bis(methoxymethyl)butylcyclobutane has a molecular weight of 200.32 g/mol, XLogP of 2.87, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(methoxymethyl)butylcyclobutane is sourced from PubChem (CID 141250149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).