dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate

C18H30O4Si — CID 11013195

IUPACdimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
SMILESC=C1CC(C(=O)OC)(C(=O)OC)C(C)/C1=C/[Si](CC)(CC)CC
InChIInChI=1S/C18H30O4Si/c1-8-23(9-2,10-3)12-15-13(4)11-18(14(15)5,16(19)21-6)17(20)22-7/h12,14H,4,8-11H2,1-3,5-7H3/b15-12+
InChIKeyAMTIVHWPRWEISA-NTCAYCPXSA-N
MW338.52 g/mol
LogP3.89
Rot. Bonds6

About dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate

dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate (PubChem CID 11013195) has the molecular formula C18H30O4Si and a molecular weight of 338.52 g/mol. Its IUPAC name is dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate.

Molecular Properties

Compound Namedimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
PubChem CID11013195
Molecular FormulaC18H30O4Si
Molecular Weight338.52 g/mol
Exact Mass338.19
IUPAC Namedimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
SMILESC=C1CC(C(=O)OC)(C(=O)OC)C(C)/C1=C/[Si](CC)(CC)CC
InChIInChI=1S/C18H30O4Si/c1-8-23(9-2,10-3)12-15-13(4)11-18(14(15)5,16(19)21-6)17(20)22-7/h12,14H,4,8-11H2,1-3,5-7H3/b15-12+
InChIKeyAMTIVHWPRWEISA-NTCAYCPXSA-N
XLogP3.89
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.52
LogP ≤ 53.89
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 (3Z,4Z)-3-(tributylstannylmethylidene)-4-(trimethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 11786432
dimethyl (4Z)-3-methylidene-4-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 101130864
dimethyl (3Z,4Z)-3-(tributylstannylmethylidene)-4-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 164686401
Dimethyl 2-ethenylcyclopentane-1,1-dicarboxylate
CID 10703747
dimethyl 4-methyl-8-trimethylsilyl-3,3a,6,7-tetrahydro-1H-azulene-2,2-dicarboxylate
CID 10735625
diethyl 2-[(3E)-3-(trimethylsilylmethylidene)nonan-2-yl]propanedioate
CID 10992304
dimethyl (2R)-2-ethenylcyclopentane-1,1-dicarboxylate
CID 11085103
2-O-ethyl 1-O,1-O'-dimethyl (3E)-3-(trimethylsilylmethylidene)cyclopentane-1,1,2-tricarboxylate
CID 46866730
Dimethyl 3-methylidene-4-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 85378686
dimethyl (4E)-3-prop-1-en-2-yl-4-(trimethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 101546111
dimethyl (2E)-2-(trimethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 102051620
dimethyl (4E)-3-methylidene-4-(trimethylsilylmethylidene)cyclopentane-1,1-dicarboxylate
CID 102377343

Frequently Asked Questions

What is the IUPAC name of dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate?
The IUPAC name of dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate (CID 11013195) is dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate.
What is the SMILES notation for dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate?
The canonical SMILES for dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate is C=C1CC(C(=O)OC)(C(=O)OC)C(C)/C1=C/[Si](CC)(CC)CC.
What is the InChIKey of dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate?
The InChIKey is AMTIVHWPRWEISA-NTCAYCPXSA-N. The full InChI is InChI=1S/C18H30O4Si/c1-8-23(9-2,10-3)12-15-13(4)11-18(14(15)5,16(19)21-6)17(20)22-7/h12,14H,4,8-11H2,1-3,5-7H3/b15-12+.
What are the key properties of dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate?
dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate has a molecular weight of 338.52 g/mol, XLogP of 3.89, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl (3Z)-2-methyl-4-methylidene-3-(triethylsilylmethylidene)cyclopentane-1,1-dicarboxylate is sourced from PubChem (CID 11013195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).