trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol

C19H36OSi — CID 10881406

IUPACtrans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol
SMILESC=C[C@]1(O)CCCC[C@H]1C(=C)[Si](CCC)(CCC)CCC
InChIInChI=1S/C19H36OSi/c1-6-14-21(15-7-2,16-8-3)17(5)18-12-10-11-13-19(18,20)9-4/h9,18,20H,4-8,10-16H2,1-3H3/t18-,19-/m0/s1
InChIKeyWWTZPFURNAMDTJ-OALUTQOASA-N
MW308.58 g/mol
LogP5.87
Rot. Bonds9

About trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol

trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol (PubChem CID 10881406) has the molecular formula C19H36OSi and a molecular weight of 308.58 g/mol. Its IUPAC name is trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol.

Molecular Properties

Compound Nametrans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol
PubChem CID10881406
Molecular FormulaC19H36OSi
Molecular Weight308.58 g/mol
Exact Mass308.25
IUPAC Nametrans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol
SMILESC=C[C@]1(O)CCCC[C@H]1C(=C)[Si](CCC)(CCC)CCC
InChIInChI=1S/C19H36OSi/c1-6-14-21(15-7-2,16-8-3)17(5)18-12-10-11-13-19(18,20)9-4/h9,18,20H,4-8,10-16H2,1-3H3/t18-,19-/m0/s1
InChIKeyWWTZPFURNAMDTJ-OALUTQOASA-N
XLogP5.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.58
LogP ≤ 55.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol?
The IUPAC name of trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol (CID 10881406) is trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol.
What is the SMILES notation for trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol?
The canonical SMILES for trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol is C=C[C@]1(O)CCCC[C@H]1C(=C)[Si](CCC)(CCC)CCC.
What is the InChIKey of trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol?
The InChIKey is WWTZPFURNAMDTJ-OALUTQOASA-N. The full InChI is InChI=1S/C19H36OSi/c1-6-14-21(15-7-2,16-8-3)17(5)18-12-10-11-13-19(18,20)9-4/h9,18,20H,4-8,10-16H2,1-3H3/t18-,19-/m0/s1.
What are the key properties of trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol?
trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol has a molecular weight of 308.58 g/mol, XLogP of 5.87, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-1-ethenyl-2-(1-tripropylsilylethenyl)cyclohexan-1-ol is sourced from PubChem (CID 10881406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).