1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol

C13H24OSi — CID 11138784

IUPAC1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol
SMILESC=C=C(C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C13H24OSi/c1-5-12(15(2,3)4)13(14)11-9-7-6-8-10-11/h11,13-14H,1,6-10H2,2-4H3
InChIKeyATSZCLXAVZIZRW-UHFFFAOYSA-N
MW224.42 g/mol
LogP3.52
Rot. Bonds3

About 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol

1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol (PubChem CID 11138784) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol.

Molecular Properties

Compound Name1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol
PubChem CID11138784
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol
SMILESC=C=C(C(O)C1CCCCC1)[Si](C)(C)C
InChIInChI=1S/C13H24OSi/c1-5-12(15(2,3)4)13(14)11-9-7-6-8-10-11/h11,13-14H,1,6-10H2,2-4H3
InChIKeyATSZCLXAVZIZRW-UHFFFAOYSA-N
XLogP3.52
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

1-Cyclohexylbuta-2,3-dien-1-ol
CID 10942646
(E)-1-cyclohexyl-4-trimethylsilylbut-3-en-1-ol
CID 12022452
1-Cyclohexyl-2-tri(propan-2-yl)silylbuta-2,3-dien-1-ol
CID 101261971
1-Cyclohexyl-2-methyl-2-propen-1-ol
CID 24059333
(E)-1-cyclohexyl-3-triethylsilylprop-2-en-1-ol
CID 10060901
(Z)-1-cyclohexyl-3-tributylstannyl-3-trimethylsilylprop-2-en-1-ol
CID 10458683
(1R)-1-cyclohexyl-2-trimethylsilylpenta-2,3-dien-1-ol
CID 10586052
(1R)-1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol
CID 10846799
cis-(1R,2S)-2-[(E)-3-trimethylsilylprop-2-enyl]cyclohexan-1-ol
CID 10932774
(1S)-1-cyclohexylbuta-2,3-dien-1-ol
CID 10986438
(1R,2R,3R)-2-prop-2-enyl-3-trimethylsilylcyclohexan-1-ol
CID 10998343
cis-(1S,2R)-2-[(Z)-2-trimethylsilylethenyl]cyclohexan-1-ol
CID 12023488

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol?
The IUPAC name of 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol (CID 11138784) is 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol.
What is the SMILES notation for 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol?
The canonical SMILES for 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol is C=C=C(C(O)C1CCCCC1)[Si](C)(C)C.
What is the InChIKey of 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol?
The InChIKey is ATSZCLXAVZIZRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24OSi/c1-5-12(15(2,3)4)13(14)11-9-7-6-8-10-11/h11,13-14H,1,6-10H2,2-4H3.
What are the key properties of 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol?
1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol has a molecular weight of 224.42 g/mol, XLogP of 3.52, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-trimethylsilylbuta-2,3-dien-1-ol is sourced from PubChem (CID 11138784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).