CID 18709860

C18H31OSi — CID 18709860

IUPAC—
SMILESC=[Si]OC1CCC2=CC(C)C(C(C)(C)C)CC2(C)C1C
InChIInChI=1S/C18H31OSi/c1-12-10-14-8-9-16(19-20-7)13(2)18(14,6)11-15(12)17(3,4)5/h10,12-13,15-16H,7-9,11H2,1-6H3
InChIKeyJNDAVGTXFUSAFA-UHFFFAOYSA-N
MW291.53 g/mol
LogP4.49
Rot. Bonds2

About CID 18709860

CID 18709860 (PubChem CID 18709860) has the molecular formula C18H31OSi and a molecular weight of 291.53 g/mol.

Molecular Properties

Compound NameCID 18709860
PubChem CID18709860
Molecular FormulaC18H31OSi
Molecular Weight291.53 g/mol
Exact Mass291.21
IUPAC Name—
SMILESC=[Si]OC1CCC2=CC(C)C(C(C)(C)C)CC2(C)C1C
InChIInChI=1S/C18H31OSi/c1-12-10-14-8-9-16(19-20-7)13(2)18(14,6)11-15(12)17(3,4)5/h10,12-13,15-16H,7-9,11H2,1-6H3
InChIKeyJNDAVGTXFUSAFA-UHFFFAOYSA-N
XLogP4.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.53
LogP ≤ 54.49
H-Bond Donors ≤ 50
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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Related Compounds

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CID 70928447
[(1S,4aS,8aS)-8a-methyl-4a-prop-2-ynyl-1,2,3,4,7,8-hexahydronaphthalen-1-yl]oxy-tert-butyl-dimethylsilane
CID 102085280
tert-butyl-[[(1S,2S,4S,5S)-4-[(3S)-3,7-dimethyloct-6-enyl]-4,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]oxy]-dimethylsilane
CID 134865393
[(5S,6R,9S,10R)-3,6-dimethyl-9-propan-2-ylspiro[4.5]dec-3-en-10-yl]oxy-triethylsilane
CID 135019405
[(2S,4aR,8aR)-1,1,4a-trimethyl-6-(2-trimethylsilylethynyl)-2,3,4,7,8,8a-hexahydronaphthalen-2-yl]oxy-tert-butyl-dimethylsilane
CID 155933466
[(1R,4aR,8aR)-8a-methyl-7-methylidene-1,2,3,4,4a,5,6,8-octahydronaphthalen-1-yl]oxy-tert-butyl-dimethylsilane
CID 10017362
[(1R,8aR)-3,3,8a-trimethyl-1,2,4,6,7,8-hexahydronaphthalen-1-yl]oxy-tert-butyl-dimethylsilane
CID 11722835
[(3aR,4S,7aS)-1-[(2R)-4-iodobutan-2-yl]-7a-methyl-3,3a,4,5,6,7-hexahydroinden-4-yl]oxy-triethylsilane
CID 10765875
Tert-butyl{[(1z,3ar,4s,7as)-1-ethylidene-7a-methyloctahydro-1h-inden-4-yl]oxy}dimethylsilane
CID 11000905
[(1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl]methoxy-tert-butyl-dimethylsilane
CID 11427684
[(1E,3aR,4S,7aS)-1-ethylidene-7a-methyl-3,3a,4,5,6,7-hexahydro-2H-inden-4-yl]oxy-tert-butyl-dimethylsilane
CID 11781393
CID 18709878
CID 18709878

Frequently Asked Questions

What is the IUPAC name of CID 18709860?
The IUPAC name of CID 18709860 (CID 18709860) is not available.
What is the SMILES notation for CID 18709860?
The canonical SMILES for CID 18709860 is C=[Si]OC1CCC2=CC(C)C(C(C)(C)C)CC2(C)C1C.
What is the InChIKey of CID 18709860?
The InChIKey is JNDAVGTXFUSAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31OSi/c1-12-10-14-8-9-16(19-20-7)13(2)18(14,6)11-15(12)17(3,4)5/h10,12-13,15-16H,7-9,11H2,1-6H3.
What are the key properties of CID 18709860?
CID 18709860 has a molecular weight of 291.53 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18709860 is sourced from PubChem (CID 18709860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).