1-methoxy-2-(methoxymethyl)-2-methylhexane

C10H22O2 — CID 18622381

IUPAC1-methoxy-2-(methoxymethyl)-2-methylhexane
SMILESCCCCC(C)(COC)COC
InChIInChI=1S/C10H22O2/c1-5-6-7-10(2,8-11-3)9-12-4/h5-9H2,1-4H3
InChIKeyUKBLNMVOCNRLKQ-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.48
Rot. Bonds7

About 1-methoxy-2-(methoxymethyl)-2-methylhexane

1-methoxy-2-(methoxymethyl)-2-methylhexane (PubChem CID 18622381) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 1-methoxy-2-(methoxymethyl)-2-methylhexane.

Molecular Properties

Compound Name1-methoxy-2-(methoxymethyl)-2-methylhexane
PubChem CID18622381
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name1-methoxy-2-(methoxymethyl)-2-methylhexane
SMILESCCCCC(C)(COC)COC
InChIInChI=1S/C10H22O2/c1-5-6-7-10(2,8-11-3)9-12-4/h5-9H2,1-4H3
InChIKeyUKBLNMVOCNRLKQ-UHFFFAOYSA-N
XLogP2.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Isobutyl-2-isopropyl-1,3-dimethoxypropane
CID 11138158
2-Butyl-2-ethyl-1,3-dimethoxypropane
CID 17809800
1-Methoxy-2-(methoxymethyl)-2-methyldecane
CID 18454984
1-Methoxy-2-methyl-2-(2,2,2-trifluoroethoxymethyl)hexane
CID 153488158
Oxetane, 3-butyl-3-methyl
CID 529293
Bis(butoxymethyl)cyclopentane
CID 91010285
1,1-Bisethoxymethyl cyclopentane
CID 156613166
1-Methoxy-2-(methoxymethyl)-2-methylpentane
CID 11040999
1-Methoxy-4,4-dimethylpentane
CID 14694583
3,3-Bis(methoxymethyl)hexane
CID 18737377
1-Methoxy-5,5-dimethylhexane
CID 20588984
1-Methoxy-2,2,4,4-tetramethylhexane
CID 20829019

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-(methoxymethyl)-2-methylhexane?
The IUPAC name of 1-methoxy-2-(methoxymethyl)-2-methylhexane (CID 18622381) is 1-methoxy-2-(methoxymethyl)-2-methylhexane.
What is the SMILES notation for 1-methoxy-2-(methoxymethyl)-2-methylhexane?
The canonical SMILES for 1-methoxy-2-(methoxymethyl)-2-methylhexane is CCCCC(C)(COC)COC.
What is the InChIKey of 1-methoxy-2-(methoxymethyl)-2-methylhexane?
The InChIKey is UKBLNMVOCNRLKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2/c1-5-6-7-10(2,8-11-3)9-12-4/h5-9H2,1-4H3.
What are the key properties of 1-methoxy-2-(methoxymethyl)-2-methylhexane?
1-methoxy-2-(methoxymethyl)-2-methylhexane has a molecular weight of 174.28 g/mol, XLogP of 2.48, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(methoxymethyl)-2-methylhexane is sourced from PubChem (CID 18622381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).