1,2-dicyclohexylhex-1-enyl(diethoxy)silane

C22H42O2Si — CID 175033559

IUPAC1,2-dicyclohexylhex-1-enyl(diethoxy)silane
SMILESCCCCC(=C(C1CCCCC1)[SiH](OCC)OCC)C1CCCCC1
InChIInChI=1S/C22H42O2Si/c1-4-7-18-21(19-14-10-8-11-15-19)22(20-16-12-9-13-17-20)25(23-5-2)24-6-3/h19-20,25H,4-18H2,1-3H3
InChIKeyMEATTWPHKNEDBD-UHFFFAOYSA-N
MW366.66 g/mol
LogP6.47
Rot. Bonds10

About 1,2-dicyclohexylhex-1-enyl(diethoxy)silane

1,2-dicyclohexylhex-1-enyl(diethoxy)silane (PubChem CID 175033559) has the molecular formula C22H42O2Si and a molecular weight of 366.66 g/mol. Its IUPAC name is 1,2-dicyclohexylhex-1-enyl(diethoxy)silane.

Molecular Properties

Compound Name1,2-dicyclohexylhex-1-enyl(diethoxy)silane
PubChem CID175033559
Molecular FormulaC22H42O2Si
Molecular Weight366.66 g/mol
Exact Mass366.30
IUPAC Name1,2-dicyclohexylhex-1-enyl(diethoxy)silane
SMILESCCCCC(=C(C1CCCCC1)[SiH](OCC)OCC)C1CCCCC1
InChIInChI=1S/C22H42O2Si/c1-4-7-18-21(19-14-10-8-11-15-19)22(20-16-12-9-13-17-20)25(23-5-2)24-6-3/h19-20,25H,4-18H2,1-3H3
InChIKeyMEATTWPHKNEDBD-UHFFFAOYSA-N
XLogP6.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.66
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 65399298
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CID 63409715
(1-cyclohexyl-2-ethylpent-1-enyl)cyclohexane
CID 172560766
1-cyclopentylhexan-1-imine
CID 91136727
cyclohexyl-cyclopentyl-ethoxysilane
CID 151835803
4-[2-cyclopentyl-1-(4-hydroxyphenyl)dec-1-enyl]phenol
CID 123434442
1,1-dicyclopentyl-N-pentylmethanimine
CID 21412176
cyclohexyl-ethoxy-propylsilane
CID 151439614
1,1-dicyclohexylpent-1-en-2-yl(dimethyl)phosphane
CID 90009896
1-cycloheptylbutan-1-one
CID 54353743
butyl(dicyclohexyl)stannane
CID 173454185

Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclohexylhex-1-enyl(diethoxy)silane?
The IUPAC name of 1,2-dicyclohexylhex-1-enyl(diethoxy)silane (CID 175033559) is 1,2-dicyclohexylhex-1-enyl(diethoxy)silane.
What is the SMILES notation for 1,2-dicyclohexylhex-1-enyl(diethoxy)silane?
The canonical SMILES for 1,2-dicyclohexylhex-1-enyl(diethoxy)silane is CCCCC(=C(C1CCCCC1)[SiH](OCC)OCC)C1CCCCC1.
What is the InChIKey of 1,2-dicyclohexylhex-1-enyl(diethoxy)silane?
The InChIKey is MEATTWPHKNEDBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H42O2Si/c1-4-7-18-21(19-14-10-8-11-15-19)22(20-16-12-9-13-17-20)25(23-5-2)24-6-3/h19-20,25H,4-18H2,1-3H3.
What are the key properties of 1,2-dicyclohexylhex-1-enyl(diethoxy)silane?
1,2-dicyclohexylhex-1-enyl(diethoxy)silane has a molecular weight of 366.66 g/mol, XLogP of 6.47, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclohexylhex-1-enyl(diethoxy)silane is sourced from PubChem (CID 175033559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).