dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate

C10H18O6 — CID 151999350

IUPACdimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate
SMILESCOC(=O)C(C)(OC)C(C)(OC)C(=O)OC
InChIInChI=1S/C10H18O6/c1-9(15-5,7(11)13-3)10(2,16-6)8(12)14-4/h1-6H3
InChIKeyUGIRDADQWHDEII-UHFFFAOYSA-N
MW234.25 g/mol
LogP0.14
Rot. Bonds5

About dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate

dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate (PubChem CID 151999350) has the molecular formula C10H18O6 and a molecular weight of 234.25 g/mol. Its IUPAC name is dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate.

Molecular Properties

Compound Namedimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate
PubChem CID151999350
Molecular FormulaC10H18O6
Molecular Weight234.25 g/mol
Exact Mass234.11
IUPAC Namedimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate
SMILESCOC(=O)C(C)(OC)C(C)(OC)C(=O)OC
InChIInChI=1S/C10H18O6/c1-9(15-5,7(11)13-3)10(2,16-6)8(12)14-4/h1-6H3
InChIKeyUGIRDADQWHDEII-UHFFFAOYSA-N
XLogP0.14
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 50.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

dipropan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate
CID 139989252
dimethyl 2-iodo-2-methylpropanedioate
CID 23080719
methyl 2-tert-butyl-2,3,3-trimethylbutanoate
CID 12696477
methyl 2-methoxy-2,3-dimethylbutanoate
CID 59972485
methyl 2-acetamido-2-methyl-3-oxobutanoate
CID 87370623
dimethyl 2-(aminomethyl)-2-methylpropanedioate;hydrochloride
CID 146155521
methyl 2-methyl-2-((111C)methylamino)propanoate
CID 10534687
3-O-(3-methoxy-2,2-dimethyl-3-oxopropanoyl) 1-O-methyl 2,2-dimethylpropanedioate
CID 139054712
methyl 2-methyl-2-(sulfanylamino)propanoate
CID 59695497
methyl 2,2-diaminopropanoate;dihydrochloride
CID 142678303
dibutan-2-yl 2,3-dimethoxy-2,3-dimethylbutanedioate
CID 139989360
methyl 2-methoxy-2-methylpent-3-enoate
CID 151422479

Frequently Asked Questions

What is the IUPAC name of dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate?
The IUPAC name of dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate (CID 151999350) is dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate.
What is the SMILES notation for dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate?
The canonical SMILES for dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate is COC(=O)C(C)(OC)C(C)(OC)C(=O)OC.
What is the InChIKey of dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate?
The InChIKey is UGIRDADQWHDEII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O6/c1-9(15-5,7(11)13-3)10(2,16-6)8(12)14-4/h1-6H3.
What are the key properties of dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate?
dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate has a molecular weight of 234.25 g/mol, XLogP of 0.14, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl 2,3-dimethoxy-2,3-dimethylbutanedioate is sourced from PubChem (CID 151999350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).