2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate

C15H32O4Si2 — CID 91209829

IUPAC2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate
SMILESCC(=CCCCO[Si](C)(C)C)C(=O)OCCO[Si](C)(C)C
InChIInChI=1S/C15H32O4Si2/c1-14(10-8-9-11-18-20(2,3)4)15(16)17-12-13-19-21(5,6)7/h10H,8-9,11-13H2,1-7H3
InChIKeySQIDWMKQXSSPQE-UHFFFAOYSA-N
MW332.59 g/mol
LogP3.96
Rot. Bonds10

About 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate

2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate (PubChem CID 91209829) has the molecular formula C15H32O4Si2 and a molecular weight of 332.59 g/mol. Its IUPAC name is 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate.

Molecular Properties

Compound Name2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate
PubChem CID91209829
Molecular FormulaC15H32O4Si2
Molecular Weight332.59 g/mol
Exact Mass332.18
IUPAC Name2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate
SMILESCC(=CCCCO[Si](C)(C)C)C(=O)OCCO[Si](C)(C)C
InChIInChI=1S/C15H32O4Si2/c1-14(10-8-9-11-18-20(2,3)4)15(16)17-12-13-19-21(5,6)7/h10H,8-9,11-13H2,1-7H3
InChIKeySQIDWMKQXSSPQE-UHFFFAOYSA-N
XLogP3.96
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.59
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

ethyl (E,5R)-5,6-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylhex-2-enoate
CID 49788313
CID 86153059
CID 86153059
diethyl (E)-5-methylidene-3-trimethylsilylhex-2-enedioate
CID 101412878
ethyl (2E,6E,10E)-12-[tert-butyl(dimethyl)silyl]oxy-2,6,11-trimethyldodeca-2,6,10-trienoate
CID 135024074
ethyl (Z)-7-[tert-butyl(dimethyl)silyl]oxy-2-methylhept-2-enoate
CID 154722964
(E)-ethyl 7-(tert-butyldimethylsiloxy)-2-methyl-2-heptenate
CID 11055704
ethyl (E)-6-[tert-butyl(dimethyl)silyl]oxy-2-methylhex-2-enoate
CID 21771056
CID 57090339
CID 57090339
CID 57270188
CID 57270188
CID 57866469
CID 57866469
6-methyl-4-(2-methyloxasilinan-2-yl)-3,4-dihydro-2H-oxepin-7-one
CID 57920975
4-[2-[butyl(dimethyl)silyl]propan-2-yloxy-dimethylsilyl]-6-methyl-3,4-dihydro-2H-oxepin-7-one
CID 58946978

Frequently Asked Questions

What is the IUPAC name of 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate?
The IUPAC name of 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate (CID 91209829) is 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate.
What is the SMILES notation for 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate?
The canonical SMILES for 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate is CC(=CCCCO[Si](C)(C)C)C(=O)OCCO[Si](C)(C)C.
What is the InChIKey of 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate?
The InChIKey is SQIDWMKQXSSPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O4Si2/c1-14(10-8-9-11-18-20(2,3)4)15(16)17-12-13-19-21(5,6)7/h10H,8-9,11-13H2,1-7H3.
What are the key properties of 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate?
2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate has a molecular weight of 332.59 g/mol, XLogP of 3.96, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylsilyloxyethyl 2-methyl-6-trimethylsilyloxyhex-2-enoate is sourced from PubChem (CID 91209829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).