trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate

C14H30O3Si2 — CID 5352358

IUPACtrimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate
SMILESCCC/C(C(=O)O[Si](C)(C)C)=C(\CC)O[Si](C)(C)C
InChIInChI=1S/C14H30O3Si2/c1-9-11-12(14(15)17-19(6,7)8)13(10-2)16-18(3,4)5/h9-11H2,1-8H3/b13-12-
InChIKeySFBVEJZEAAGDNI-SEYXRHQNSA-N
MW302.56 g/mol
LogP4.68
Rot. Bonds7

About trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate

trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate (PubChem CID 5352358) has the molecular formula C14H30O3Si2 and a molecular weight of 302.56 g/mol. Its IUPAC name is trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate.

Molecular Properties

Compound Nametrimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate
PubChem CID5352358
Molecular FormulaC14H30O3Si2
Molecular Weight302.56 g/mol
Exact Mass302.17
IUPAC Nametrimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate
SMILESCCC/C(C(=O)O[Si](C)(C)C)=C(\CC)O[Si](C)(C)C
InChIInChI=1S/C14H30O3Si2/c1-9-11-12(14(15)17-19(6,7)8)13(10-2)16-18(3,4)5/h9-11H2,1-8H3/b13-12-
InChIKeySFBVEJZEAAGDNI-SEYXRHQNSA-N
XLogP4.68
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.56
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

trimethylsilyl 2-oxopentanoate
CID 530075
trimethylsilyl (2Z)-2-methoxyiminopentanoate
CID 5366686
trimethylsilyl 2-methyl-3-trimethylsilyloxyhex-2-eneperoxoate
CID 173459969
trimethylsilyl (E)-2-propylpent-2-enoate
CID 5352357
trimethylsilyl (2E)-2-propylpenta-2,4-dienoate
CID 5352354
trimethylsilyl icosanoate
CID 521648
4,5-dipropyloct-4-ene-3,6-dione
CID 142732258
dimethyl 2,3-dipropylbut-2-enedioate
CID 86118404
(E)-N,N-dimethyl-5-trimethylsilyloxyoct-4-en-4-amine
CID 10857701
trimethylsilyl 2-oxopropanoate
CID 554459
diethyl 2-ethyl-3-propylbut-2-enedioate
CID 123725438
trimethylsilyl (2E)-2-trimethylsilyloxyiminohexanoate
CID 5463671

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate?
The IUPAC name of trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate (CID 5352358) is trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate.
What is the SMILES notation for trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate?
The canonical SMILES for trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate is CCC/C(C(=O)O[Si](C)(C)C)=C(\CC)O[Si](C)(C)C.
What is the InChIKey of trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate?
The InChIKey is SFBVEJZEAAGDNI-SEYXRHQNSA-N. The full InChI is InChI=1S/C14H30O3Si2/c1-9-11-12(14(15)17-19(6,7)8)13(10-2)16-18(3,4)5/h9-11H2,1-8H3/b13-12-.
What are the key properties of trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate?
trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate has a molecular weight of 302.56 g/mol, XLogP of 4.68, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (Z)-2-propyl-3-trimethylsilyloxypent-2-enoate is sourced from PubChem (CID 5352358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).