copper;3-methoxy-3-methylbutan-1-ol

C6H14CuO2 — CID 87410693

IUPACcopper;3-methoxy-3-methylbutan-1-ol
SMILESCOC(C)(C)CCO.[Cu]
InChIInChI=1S/C6H14O2.Cu/c1-6(2,8-3)4-5-7;/h7H,4-5H2,1-3H3;
InChIKeyNILIBFFSLFDSLE-UHFFFAOYSA-N
MW181.72 g/mol
LogP0.79
Rot. Bonds3

About copper;3-methoxy-3-methylbutan-1-ol

copper;3-methoxy-3-methylbutan-1-ol (PubChem CID 87410693) has the molecular formula C6H14CuO2 and a molecular weight of 181.72 g/mol. Its IUPAC name is copper;3-methoxy-3-methylbutan-1-ol.

Molecular Properties

Compound Namecopper;3-methoxy-3-methylbutan-1-ol
PubChem CID87410693
Molecular FormulaC6H14CuO2
Molecular Weight181.72 g/mol
Exact Mass181.03
IUPAC Namecopper;3-methoxy-3-methylbutan-1-ol
SMILESCOC(C)(C)CCO.[Cu]
InChIInChI=1S/C6H14O2.Cu/c1-6(2,8-3)4-5-7;/h7H,4-5H2,1-3H3;
InChIKeyNILIBFFSLFDSLE-UHFFFAOYSA-N
XLogP0.79
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.72
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methoxy-3-methylbutan-1-ol;hydrate
CID 141489643
2,5-dimethoxy-2,5-dimethylhexane
CID 552009
7-methoxy-7-methyloctan-1-ol
CID 175444354
3-methoxy-3-methylbutan-1-ol;3-methylbutanamide
CID 170646143
2-(3-methoxy-3-methylbutyl)sulfanylethanol
CID 102975050
3-(methoxymethoxy)-3-methylbutan-1-ol
CID 55264350
N,3-dimethylbutan-1-amine;ethane;3-methoxy-3-methylbutan-1-ol
CID 176553145
5-methoxy-2,5-dimethylhexan-2-ol
CID 21053495
4-(3-methoxy-3-methylbutoxy)-4-methylpentan-1-ol
CID 170009716
ethane-1,2-diol;(3-methoxy-3-methylbutyl) acetate
CID 146356038
2-ethyl-2-(3-methoxy-3-methylbutyl)propane-1,3-diol
CID 103018825
1-iodo-3-methoxy-3-methylbutane
CID 22236489

Frequently Asked Questions

What is the IUPAC name of copper;3-methoxy-3-methylbutan-1-ol?
The IUPAC name of copper;3-methoxy-3-methylbutan-1-ol (CID 87410693) is copper;3-methoxy-3-methylbutan-1-ol.
What is the SMILES notation for copper;3-methoxy-3-methylbutan-1-ol?
The canonical SMILES for copper;3-methoxy-3-methylbutan-1-ol is COC(C)(C)CCO.[Cu].
What is the InChIKey of copper;3-methoxy-3-methylbutan-1-ol?
The InChIKey is NILIBFFSLFDSLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2.Cu/c1-6(2,8-3)4-5-7;/h7H,4-5H2,1-3H3;.
What are the key properties of copper;3-methoxy-3-methylbutan-1-ol?
copper;3-methoxy-3-methylbutan-1-ol has a molecular weight of 181.72 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;3-methoxy-3-methylbutan-1-ol is sourced from PubChem (CID 87410693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).