4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one

C10H10O7 — CID 142757881

IUPAC4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one
SMILESCc1oc(=O)oc1COCc1oc(=O)oc1C
InChIInChI=1S/C10H10O7/c1-5-7(16-9(11)14-5)3-13-4-8-6(2)15-10(12)17-8/h3-4H2,1-2H3
InChIKeyRPYUREDCNIBJCL-UHFFFAOYSA-N
MW242.18 g/mol
LogP1.11
Rot. Bonds4

About 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one

4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one (PubChem CID 142757881) has the molecular formula C10H10O7 and a molecular weight of 242.18 g/mol. Its IUPAC name is 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one.

Molecular Properties

Compound Name4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one
PubChem CID142757881
Molecular FormulaC10H10O7
Molecular Weight242.18 g/mol
Exact Mass242.04
IUPAC Name4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one
SMILESCc1oc(=O)oc1COCc1oc(=O)oc1C
InChIInChI=1S/C10H10O7/c1-5-7(16-9(11)14-5)3-13-4-8-6(2)15-10(12)17-8/h3-4H2,1-2H3
InChIKeyRPYUREDCNIBJCL-UHFFFAOYSA-N
XLogP1.11
TPSA95.93 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.18
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one with MolForge

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Related Compounds

4-[(Acetyloxy)methyl]-5-methyl-1,3-dioxol-2-one
CID 19611268
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl formate
CID 10702077
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl butanoate
CID 15135437
4-(Ethylperoxymethyl)-5-methyl-1,3-dioxol-2-one
CID 20720716
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 2,2-dimethylpropanoate
CID 21061601
Olmesartan Medoxomil Impurity 164
CID 21138956
4-Methyl-5-[(2-methylpropan-2-yl)oxymethyl]-1,3-dioxol-2-one
CID 21138960
4-Methyl-5-(methylperoxymethyl)-1,3-dioxol-2-one
CID 21355716
4-(Methoxymethyl)-5-methyl-1,3-dioxol-2-one
CID 21362368
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 2-methylpropanoate
CID 57887012
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl propanoate
CID 58506363
4-Methyl-5-(prop-1-en-2-yloxymethyl)-1,3-dioxol-2-one
CID 58840443

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one?
The IUPAC name of 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one (CID 142757881) is 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one.
What is the SMILES notation for 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one?
The canonical SMILES for 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one is Cc1oc(=O)oc1COCc1oc(=O)oc1C.
What is the InChIKey of 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one?
The InChIKey is RPYUREDCNIBJCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O7/c1-5-7(16-9(11)14-5)3-13-4-8-6(2)15-10(12)17-8/h3-4H2,1-2H3.
What are the key properties of 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one?
4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one has a molecular weight of 242.18 g/mol, XLogP of 1.11, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-[(5-methyl-2-oxo-1,3-dioxol-4-yl)methoxymethyl]-1,3-dioxol-2-one is sourced from PubChem (CID 142757881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).