(E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol

C13H30OSi2 — CID 15570156

IUPAC(E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol
SMILESCCCC(O)C(/C=C/[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H30OSi2/c1-8-9-12(14)13(16(5,6)7)10-11-15(2,3)4/h10-14H,8-9H2,1-7H3/b11-10+
InChIKeyHACYHPQWIDVIGH-ZHACJKMWSA-N
MW258.55 g/mol
LogP4.29
Rot. Bonds6

About (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol

(E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol (PubChem CID 15570156) has the molecular formula C13H30OSi2 and a molecular weight of 258.55 g/mol. Its IUPAC name is (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol.

Molecular Properties

Compound Name(E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol
PubChem CID15570156
Molecular FormulaC13H30OSi2
Molecular Weight258.55 g/mol
Exact Mass258.18
IUPAC Name(E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol
SMILESCCCC(O)C(/C=C/[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C13H30OSi2/c1-8-9-12(14)13(16(5,6)7)10-11-15(2,3)4/h10-14H,8-9H2,1-7H3/b11-10+
InChIKeyHACYHPQWIDVIGH-ZHACJKMWSA-N
XLogP4.29
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.55
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(Trimethylsilylmethyl)hept-1-en-4-ol
CID 10726730
(Z)-5-trimethylsilylpent-4-en-2-ol
CID 11480588
(4S,6R)-6-[tert-butyl(dimethyl)silyl]oxyhept-1-en-4-ol
CID 11715728
(2S)-4-(trimethylsilylmethyl)pent-4-en-2-ol
CID 10877610
1-Trimethylsilylpent-4-en-1-ol
CID 12887657
5-(Trimethylsilylmethyl)hepta-5,6-dien-3-ol
CID 85897177
(E)-1-trimethylsilyloct-1-en-4-ol
CID 10584209
1-[Dimethyl(prop-2-enyl)silyl]hexan-3-ol
CID 10631890
(E)-6-trimethylsilylhex-5-en-3-ol
CID 10702355
(4S)-7-trimethylsilylhept-1-en-6-yn-4-ol
CID 10921159
1-Trimethylsilylhept-6-en-1-yn-3-ol
CID 11137772
(Z)-6-trimethylsilylhex-5-en-1-ol
CID 11636893

Frequently Asked Questions

What is the IUPAC name of (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol?
The IUPAC name of (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol (CID 15570156) is (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol.
What is the SMILES notation for (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol?
The canonical SMILES for (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol is CCCC(O)C(/C=C/[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol?
The InChIKey is HACYHPQWIDVIGH-ZHACJKMWSA-N. The full InChI is InChI=1S/C13H30OSi2/c1-8-9-12(14)13(16(5,6)7)10-11-15(2,3)4/h10-14H,8-9H2,1-7H3/b11-10+.
What are the key properties of (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol?
(E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol has a molecular weight of 258.55 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,3-bis(trimethylsilyl)hept-1-en-4-ol is sourced from PubChem (CID 15570156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).