(8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile

C20H37NOSi — CID 87865686

IUPAC(8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile
SMILESC[Si](C)(C)OC1(C#N)CCCCCC/C=C\CCCCCCC1
InChIInChI=1S/C20H37NOSi/c1-23(2,3)22-20(19-21)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20/h4-5H,6-18H2,1-3H3/b5-4-
InChIKeySFZLOIPEELWHNA-PLNGDYQASA-N
MW335.61 g/mol
LogP6.74
Rot. Bonds2

About (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile

(8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile (PubChem CID 87865686) has the molecular formula C20H37NOSi and a molecular weight of 335.61 g/mol. Its IUPAC name is (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile.

Molecular Properties

Compound Name(8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile
PubChem CID87865686
Molecular FormulaC20H37NOSi
Molecular Weight335.61 g/mol
Exact Mass335.26
IUPAC Name(8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile
SMILESC[Si](C)(C)OC1(C#N)CCCCCC/C=C\CCCCCCC1
InChIInChI=1S/C20H37NOSi/c1-23(2,3)22-20(19-21)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20/h4-5H,6-18H2,1-3H3/b5-4-
InChIKeySFZLOIPEELWHNA-PLNGDYQASA-N
XLogP6.74
TPSA33.02 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500335.61
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

(3E)-5,5-dimethyl-2-(6-methylhept-6-en-2-yl)-2-trimethylsilyloxyocta-3,7-dienenitrile
CID 57412515
2-[(E)-2-[tert-butyl(dimethyl)silyl]oxy-2-cyclohexylethenyl]pentanenitrile
CID 135070620
5-methyl-2-[[(1S)-4-tri(propan-2-yl)silyloxycyclohex-3-en-1-yl]methyl]hex-4-enenitrile
CID 166440692
1-Trimethylsilyloxycycloheptadec-9-ene-1-carbonitrile
CID 53642329
(9Z)-1-trimethylsilyloxycycloheptadec-9-ene-1-carbonitrile
CID 67708583
(8E)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile
CID 69505115
1-Trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile
CID 69505118
(4Z,8Z)-1-trimethylsilyloxycyclododeca-4,8-diene-1-carbonitrile
CID 141683107
1-Trimethylsilyloxycyclododeca-4,8-diene-1-carbonitrile
CID 153914170
(1S)-1-trimethylsilyloxycyclododeca-4,8-diene-1-carbonitrile
CID 173737534
3-But-3-enyl-2,2-dimethyl-1-trimethylsilyloxycyclohex-3-ene-1-carbonitrile
CID 10564502
(3R)-3-ethenyl-3-trimethylsilyloxynonadecanenitrile
CID 11474878

Frequently Asked Questions

What is the IUPAC name of (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile?
The IUPAC name of (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile (CID 87865686) is (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile.
What is the SMILES notation for (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile?
The canonical SMILES for (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile is C[Si](C)(C)OC1(C#N)CCCCCC/C=C\CCCCCCC1.
What is the InChIKey of (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile?
The InChIKey is SFZLOIPEELWHNA-PLNGDYQASA-N. The full InChI is InChI=1S/C20H37NOSi/c1-23(2,3)22-20(19-21)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20/h4-5H,6-18H2,1-3H3/b5-4-.
What are the key properties of (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile?
(8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile has a molecular weight of 335.61 g/mol, XLogP of 6.74, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8Z)-1-trimethylsilyloxycyclohexadec-8-ene-1-carbonitrile is sourced from PubChem (CID 87865686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).