(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol

C14H30O2Si — CID 13382779

IUPAC(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol
SMILESCCCCCCC(C)(O)/C(=C\CO)[Si](C)(C)C
InChIInChI=1S/C14H30O2Si/c1-6-7-8-9-11-14(2,16)13(10-12-15)17(3,4)5/h10,15-16H,6-9,11-12H2,1-5H3/b13-10+
InChIKeyLSEBUHZSYPZVNF-JLHYYAGUSA-N
MW258.48 g/mol
LogP3.50
Rot. Bonds8

About (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol

(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol (PubChem CID 13382779) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol.

Molecular Properties

Compound Name(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol
PubChem CID13382779
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Name(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol
SMILESCCCCCCC(C)(O)/C(=C\CO)[Si](C)(C)C
InChIInChI=1S/C14H30O2Si/c1-6-7-8-9-11-14(2,16)13(10-12-15)17(3,4)5/h10,15-16H,6-9,11-12H2,1-5H3/b13-10+
InChIKeyLSEBUHZSYPZVNF-JLHYYAGUSA-N
XLogP3.50
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cyclohexan-1-ol
CID 13183200
(E)-3-trimethylsilyldodec-2-ene-1,4-diol
CID 13382778
(E)-4-propyl-3-trimethylsilylhept-2-ene-1,4-diol
CID 13382781
1-[(E)-3-hydroxy-1-trimethylsilylprop-1-enyl]cycloheptan-1-ol
CID 13382783
(2S)-2-(cyclohexen-1-yl)-3-trimethylsilylpenta-3,4-dien-2-ol
CID 134963467
(Z)-9-[tert-butyl(dimethyl)silyl]oxy-2-methyloctadec-7-en-6-ol
CID 10251138
(E)-1-(3-methylcyclohexen-1-yl)-3-trimethylsilylprop-2-en-1-ol
CID 13212257
3-[3-[Hydroxy(dimethyl)silyl]-3-methylbutyl]cyclohex-2-en-1-ol
CID 70961148
(E)-hex-2-en-1-ol;2-methyloctan-2-ol
CID 87673623
(E)-6-[(E)-prop-1-enyl]non-7-ene-1,6-diol
CID 141309557
3-(2-Tert-butylsilyloxypropan-2-yl)cyclohex-2-en-1-ol
CID 154290636
4-[Tert-butyl(dimethyl)silyl]oxy-4-methylnon-2-en-1-ol
CID 172795634

Frequently Asked Questions

What is the IUPAC name of (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol?
The IUPAC name of (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol (CID 13382779) is (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol.
What is the SMILES notation for (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol?
The canonical SMILES for (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol is CCCCCCC(C)(O)/C(=C\CO)[Si](C)(C)C.
What is the InChIKey of (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol?
The InChIKey is LSEBUHZSYPZVNF-JLHYYAGUSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-6-7-8-9-11-14(2,16)13(10-12-15)17(3,4)5/h10,15-16H,6-9,11-12H2,1-5H3/b13-10+.
What are the key properties of (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol?
(E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol has a molecular weight of 258.48 g/mol, XLogP of 3.50, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-methyl-3-trimethylsilyldec-2-ene-1,4-diol is sourced from PubChem (CID 13382779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).