ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane

C23H38Si — CID 123784930

IUPACethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane
SMILESCCCC1CCC(C2CCC(c3ccc([SiH2]CC)cc3)CC2)CC1
InChIInChI=1S/C23H38Si/c1-3-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)22-14-16-23(17-15-22)24-4-2/h14-21H,3-13,24H2,1-2H3
InChIKeyCUPYKPJBVYRZGK-UHFFFAOYSA-N
MW342.64 g/mol
LogP5.80
Rot. Bonds6

About ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane

ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane (PubChem CID 123784930) has the molecular formula C23H38Si and a molecular weight of 342.64 g/mol. Its IUPAC name is ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane.

Molecular Properties

Compound Nameethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane
PubChem CID123784930
Molecular FormulaC23H38Si
Molecular Weight342.64 g/mol
Exact Mass342.27
IUPAC Nameethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane
SMILESCCCC1CCC(C2CCC(c3ccc([SiH2]CC)cc3)CC2)CC1
InChIInChI=1S/C23H38Si/c1-3-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)22-14-16-23(17-15-22)24-4-2/h14-21H,3-13,24H2,1-2H3
InChIKeyCUPYKPJBVYRZGK-UHFFFAOYSA-N
XLogP5.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.64
LogP ≤ 55.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-methyl-4-[4-(4-pentylcyclohexyl)cyclohexyl]benzene;bis(1-methyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene)
CID 161029870
1-phenyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 54467761
1-(4-ethylcyclohexyl)-4-(4-propylcyclohexyl)benzene
CID 20538372
1-[(1R,2R)-2-fluorocyclopropyl]-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 139666683
pentafluoro-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]-λ6-sulfane
CID 54147756
1-[(E)-prop-1-enyl]-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 59247481
1-methyl-4-[[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]methyl]benzene
CID 58932728
(4-propylcyclohexyl)benzene
CID 155887669
2-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]acetic acid
CID 19026680
1-[4-(4-butylcyclohexyl)cyclohexyl]-4-methylbenzene;1-[4-(4-ethylcyclohexyl)cyclohexyl]-4-methylbenzene;methane;1-methyl-4-[4-(4-pentylcyclohexyl)cyclohexyl]benzene;1-methyl-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 160680603
1-(4-propylcyclohexyl)-4-[4-(4-propylcyclohexyl)phenoxy]benzene
CID 19700194
4-[4-(4-heptylcyclohexyl)cyclohexyl]phenol
CID 139983091

Frequently Asked Questions

What is the IUPAC name of ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane?
The IUPAC name of ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane (CID 123784930) is ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane.
What is the SMILES notation for ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane?
The canonical SMILES for ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane is CCCC1CCC(C2CCC(c3ccc([SiH2]CC)cc3)CC2)CC1.
What is the InChIKey of ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane?
The InChIKey is CUPYKPJBVYRZGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H38Si/c1-3-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)22-14-16-23(17-15-22)24-4-2/h14-21H,3-13,24H2,1-2H3.
What are the key properties of ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane?
ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane has a molecular weight of 342.64 g/mol, XLogP of 5.80, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-[4-[4-(4-propylcyclohexyl)cyclohexyl]phenyl]silane is sourced from PubChem (CID 123784930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).