methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate

C8H14O5 — CID 11521219

IUPACmethyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate
SMILESCOC(=O)COC(=O)OC(C)(C)C
InChIInChI=1S/C8H14O5/c1-8(2,3)13-7(10)12-5-6(9)11-4/h5H2,1-4H3
InChIKeyLZLDHDVQEYUOLX-UHFFFAOYSA-N
MW190.19 g/mol
LogP1.11
Rot. Bonds2

About methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate

methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate (PubChem CID 11521219) has the molecular formula C8H14O5 and a molecular weight of 190.19 g/mol. Its IUPAC name is methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate.

Molecular Properties

Compound Namemethyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate
PubChem CID11521219
Molecular FormulaC8H14O5
Molecular Weight190.19 g/mol
Exact Mass190.08
IUPAC Namemethyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate
SMILESCOC(=O)COC(=O)OC(C)(C)C
InChIInChI=1S/C8H14O5/c1-8(2,3)13-7(10)12-5-6(9)11-4/h5H2,1-4H3
InChIKeyLZLDHDVQEYUOLX-UHFFFAOYSA-N
XLogP1.11
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.19
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate?
The IUPAC name of methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate (CID 11521219) is methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate.
What is the SMILES notation for methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate?
The canonical SMILES for methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate is COC(=O)COC(=O)OC(C)(C)C.
What is the InChIKey of methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate?
The InChIKey is LZLDHDVQEYUOLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O5/c1-8(2,3)13-7(10)12-5-6(9)11-4/h5H2,1-4H3.
What are the key properties of methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate?
methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate has a molecular weight of 190.19 g/mol, XLogP of 1.11, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-methylpropan-2-yl)oxycarbonyloxy]acetate is sourced from PubChem (CID 11521219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).