7-trimethylsilyloxyoct-7-en-2-one

C11H22O2Si — CID 101453303

IUPAC7-trimethylsilyloxyoct-7-en-2-one
SMILESC=C(CCCCC(C)=O)O[Si](C)(C)C
InChIInChI=1S/C11H22O2Si/c1-10(12)8-6-7-9-11(2)13-14(3,4)5/h2,6-9H2,1,3-5H3
InChIKeyDPRJWFWNUVJDQY-UHFFFAOYSA-N
MW214.38 g/mol
LogP3.50
Rot. Bonds7

About 7-trimethylsilyloxyoct-7-en-2-one

7-trimethylsilyloxyoct-7-en-2-one (PubChem CID 101453303) has the molecular formula C11H22O2Si and a molecular weight of 214.38 g/mol. Its IUPAC name is 7-trimethylsilyloxyoct-7-en-2-one.

Molecular Properties

Compound Name7-trimethylsilyloxyoct-7-en-2-one
PubChem CID101453303
Molecular FormulaC11H22O2Si
Molecular Weight214.38 g/mol
Exact Mass214.14
IUPAC Name7-trimethylsilyloxyoct-7-en-2-one
SMILESC=C(CCCCC(C)=O)O[Si](C)(C)C
InChIInChI=1S/C11H22O2Si/c1-10(12)8-6-7-9-11(2)13-14(3,4)5/h2,6-9H2,1,3-5H3
InChIKeyDPRJWFWNUVJDQY-UHFFFAOYSA-N
XLogP3.50
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.38
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl 4-trimethylsilyloxypent-4-enoate
CID 13353135
pentadecane-2,14-dione
CID 10966641
docosane-2,21-dione
CID 537416
19-methylicos-19-en-2-one
CID 170573260
1-[4-(3-trimethylsilyloxybut-3-enyl)phenyl]ethanone
CID 24746358
2-methylidene-7-oxooctanoic acid
CID 87625234
dotriactane-2,7,8,13,14,19,20,25,26,31,32,37,38,43,44,49,50,55,56,61,62,67,68,73,74,79,80,85,86,91,92,97,98,103,104,109,110,115,116,121,122,127,128,133,134,139,140,145,146,151,152,157,158,163,164,169,170,175,176,181,182,187,188,193,194,199,200,205,206,211,212,217,218,223,224,229,230,235,236,241,242,247,248,253,254,259,260,265,266,271,272,277,278,283,284,289,290,295,296,301-hectone
CID 140812366
3-bromoprop-1-en-2-yloxy(trimethyl)silane
CID 12739597
1-O-prop-1-en-2-yl 4-O-trimethylsilyl butanedioate
CID 552478
7-(hydroxyamino)oct-7-en-2-one
CID 143059142
ethane-1,2-diol;trimethylsilyl 2-methylprop-2-enoate
CID 87381259
6,10-dimethylundeca-1,5,9-trien-2-yloxy(trimethyl)silane
CID 73116947

Frequently Asked Questions

What is the IUPAC name of 7-trimethylsilyloxyoct-7-en-2-one?
The IUPAC name of 7-trimethylsilyloxyoct-7-en-2-one (CID 101453303) is 7-trimethylsilyloxyoct-7-en-2-one.
What is the SMILES notation for 7-trimethylsilyloxyoct-7-en-2-one?
The canonical SMILES for 7-trimethylsilyloxyoct-7-en-2-one is C=C(CCCCC(C)=O)O[Si](C)(C)C.
What is the InChIKey of 7-trimethylsilyloxyoct-7-en-2-one?
The InChIKey is DPRJWFWNUVJDQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-10(12)8-6-7-9-11(2)13-14(3,4)5/h2,6-9H2,1,3-5H3.
What are the key properties of 7-trimethylsilyloxyoct-7-en-2-one?
7-trimethylsilyloxyoct-7-en-2-one has a molecular weight of 214.38 g/mol, XLogP of 3.50, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-trimethylsilyloxyoct-7-en-2-one is sourced from PubChem (CID 101453303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).