3-(methoxymethoxy)-3-methylbutan-1-ol

C7H16O3 — CID 55264350

IUPAC3-(methoxymethoxy)-3-methylbutan-1-ol
SMILESCOCOC(C)(C)CCO
InChIInChI=1S/C7H16O3/c1-7(2,4-5-8)10-6-9-3/h8H,4-6H2,1-3H3
InChIKeyBESXCEKGHOTTQS-UHFFFAOYSA-N
MW148.20 g/mol
LogP0.77
Rot. Bonds5

About 3-(methoxymethoxy)-3-methylbutan-1-ol

3-(methoxymethoxy)-3-methylbutan-1-ol (PubChem CID 55264350) has the molecular formula C7H16O3 and a molecular weight of 148.20 g/mol. Its IUPAC name is 3-(methoxymethoxy)-3-methylbutan-1-ol.

Molecular Properties

Compound Name3-(methoxymethoxy)-3-methylbutan-1-ol
PubChem CID55264350
Molecular FormulaC7H16O3
Molecular Weight148.20 g/mol
Exact Mass148.11
IUPAC Name3-(methoxymethoxy)-3-methylbutan-1-ol
SMILESCOCOC(C)(C)CCO
InChIInChI=1S/C7H16O3/c1-7(2,4-5-8)10-6-9-3/h8H,4-6H2,1-3H3
InChIKeyBESXCEKGHOTTQS-UHFFFAOYSA-N
XLogP0.77
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-methoxy-3-methylbutan-1-ol;hydrate
CID 141489643
copper;3-methoxy-3-methylbutan-1-ol
CID 87410693
1-(4-hydroxy-2-methylbutan-2-yl)oxy-3-methylbutan-2-one
CID 123147699
3-[3-[2-hydroxy-3-[4-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylbutan-2-yl]oxypropoxy]-3-methylbutoxy]-3-methylbutan-1-ol
CID 121265139
N-[1-(4-hydroxy-2-methylbutan-2-yl)oxy-2-methylpropan-2-yl]acetamide
CID 153358317
triethyl 2-(4-hydroxy-2-methylbutan-2-yl)oxyethyl silicate
CID 91305541
4-(3-methoxy-3-methylbutoxy)-4-methylpentan-1-ol
CID 170009716
3-methyl-3-(2-methylpropoxy)butan-1-ol;1-propoxypropane
CID 87248461
3-(3-isocyanatopropoxy)-3-methylbutan-1-ol
CID 165125344
2,2-bis(hydroxymethyl)propane-1,3-diol;dimethoxymethane
CID 158716862
3-[(E)-3-(2-aminoethoxy)but-2-enoxy]-3-methylbutan-1-ol
CID 173467786
[3-[2-[3-[2-[3-[2-[3-(2-hydroxyethoxy)-3-methylbutoxy]carbonyloxyethoxy]-3-methylbutoxy]carbonyloxyethoxy]-3-methylbutoxy]carbonyloxyethoxy]-3-methylbutyl] methoxymethoxymethoxymethoxymethyl carbonate
CID 130210461

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethoxy)-3-methylbutan-1-ol?
The IUPAC name of 3-(methoxymethoxy)-3-methylbutan-1-ol (CID 55264350) is 3-(methoxymethoxy)-3-methylbutan-1-ol.
What is the SMILES notation for 3-(methoxymethoxy)-3-methylbutan-1-ol?
The canonical SMILES for 3-(methoxymethoxy)-3-methylbutan-1-ol is COCOC(C)(C)CCO.
What is the InChIKey of 3-(methoxymethoxy)-3-methylbutan-1-ol?
The InChIKey is BESXCEKGHOTTQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O3/c1-7(2,4-5-8)10-6-9-3/h8H,4-6H2,1-3H3.
What are the key properties of 3-(methoxymethoxy)-3-methylbutan-1-ol?
3-(methoxymethoxy)-3-methylbutan-1-ol has a molecular weight of 148.20 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethoxy)-3-methylbutan-1-ol is sourced from PubChem (CID 55264350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).