dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate

C17H24O4Si — CID 11544278

IUPACdimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate
SMILESCOC(=O)C1(C(=O)OC)Cc2cc([Si](C)(C)C)cc(C)c2C1
InChIInChI=1S/C17H24O4Si/c1-11-7-13(22(4,5)6)8-12-9-17(10-14(11)12,15(18)20-2)16(19)21-3/h7-8H,9-10H2,1-6H3
InChIKeyONXABZFKKKFCRR-UHFFFAOYSA-N
MW320.46 g/mol
LogP1.97
Rot. Bonds3

About dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate

dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate (PubChem CID 11544278) has the molecular formula C17H24O4Si and a molecular weight of 320.46 g/mol. Its IUPAC name is dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate.

Molecular Properties

Compound Namedimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate
PubChem CID11544278
Molecular FormulaC17H24O4Si
Molecular Weight320.46 g/mol
Exact Mass320.14
IUPAC Namedimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate
SMILESCOC(=O)C1(C(=O)OC)Cc2cc([Si](C)(C)C)cc(C)c2C1
InChIInChI=1S/C17H24O4Si/c1-11-7-13(22(4,5)6)8-12-9-17(10-14(11)12,15(18)20-2)16(19)21-3/h7-8H,9-10H2,1-6H3
InChIKeyONXABZFKKKFCRR-UHFFFAOYSA-N
XLogP1.97
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.46
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

dimethyl 5-hydroxy-4,6-dimethyl-1,3-dihydroindene-2,2-dicarboxylate
CID 134929299
dimethyl 3-(chloromethyl)-1-trimethylsilyl-5,7-dihydrocyclopenta[c]pyridine-6,6-dicarboxylate
CID 101408805
tetramethyl 1,3-dihydroindene-2,2,4,6-tetracarboxylate
CID 11727810
dimethyl 6-methoxy-5-trimethylsilyl-4-(2-trimethylsilylethynyl)-1,3-dihydroindene-2,2-dicarboxylate
CID 71680037
tetramethyl 4-azatetracyclo[7.6.1.05,16.010,14]hexadeca-1(15),2,4,9(16),10(14)-pentaene-7,7,12,12-tetracarboxylate
CID 102483815
dimethyl 1-methyl-3-phenylimino-5,7-dihydrocyclopenta[c]thiopyran-6,6-dicarboxylate
CID 101357266
diethyl 4-methyl-1,3,6,8-tetrahydrocyclopenta[e][2]benzofuran-7,7-dicarboxylate
CID 11088426
dimethyl 5-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-4-methyl-1,3-dihydroindene-2,2-dicarboxylate
CID 102184577
dimethyl 1,3-bis(4-methoxyphenyl)-4,6-dihydrocyclopenta[c]furan-5,5-dicarboxylate
CID 132990625
dimethyl 3-(dimethylamino)-5,7-dihydrocyclopenta[c]pyridine-6,6-dicarboxylate
CID 101363600
dimethyl 6-trimethylsilyl-1,3,4,5-tetrahydroindene-2,2-dicarboxylate
CID 11558617
dimethyl 2-acetyl-1,3-dihydroindene-2,5-dicarboxylate
CID 10468672

Frequently Asked Questions

What is the IUPAC name of dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate?
The IUPAC name of dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate (CID 11544278) is dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate.
What is the SMILES notation for dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate?
The canonical SMILES for dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate is COC(=O)C1(C(=O)OC)Cc2cc([Si](C)(C)C)cc(C)c2C1.
What is the InChIKey of dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate?
The InChIKey is ONXABZFKKKFCRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O4Si/c1-11-7-13(22(4,5)6)8-12-9-17(10-14(11)12,15(18)20-2)16(19)21-3/h7-8H,9-10H2,1-6H3.
What are the key properties of dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate?
dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate has a molecular weight of 320.46 g/mol, XLogP of 1.97, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl 4-methyl-6-trimethylsilyl-1,3-dihydroindene-2,2-dicarboxylate is sourced from PubChem (CID 11544278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).