[4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane

C7H18OS2Si — CID 151651350

IUPAC[4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane
SMILESCCO[SiH2]C(C)(C)CCSS
InChIInChI=1S/C7H18OS2Si/c1-4-8-11-7(2,3)5-6-10-9/h9H,4-6,11H2,1-3H3
InChIKeyQUOQRQMVRDSLQC-UHFFFAOYSA-N
MW210.44 g/mol
LogP2.27
Rot. Bonds6

About [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane

[4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane (PubChem CID 151651350) has the molecular formula C7H18OS2Si and a molecular weight of 210.44 g/mol. Its IUPAC name is [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane.

Molecular Properties

Compound Name[4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane
PubChem CID151651350
Molecular FormulaC7H18OS2Si
Molecular Weight210.44 g/mol
Exact Mass210.06
IUPAC Name[4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane
SMILESCCO[SiH2]C(C)(C)CCSS
InChIInChI=1S/C7H18OS2Si/c1-4-8-11-7(2,3)5-6-10-9/h9H,4-6,11H2,1-3H3
InChIKeyQUOQRQMVRDSLQC-UHFFFAOYSA-N
XLogP2.27
TPSA9.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.44
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

3-ethoxysilyl-3-methylbutane-1-thiol
CID 154092584
3-ethoxysilyl-N-(3-ethoxysilyl-3-methylbutyl)-3-methylbutan-1-amine
CID 154087119
ethoxy(2-methylnonadecan-2-yl)silane
CID 173228769
ethoxy(2-methylbutan-2-yl)silane
CID 123886977
N',N'-bis(3-ethoxysilyl-3-methylbutyl)dodecane-1,12-diamine
CID 173222832
1,1-diethoxyethyl(ethoxy)silane
CID 164998800
2,3-dimethylbutan-2-yl(ethoxy)silane
CID 123706979
3-ethoxysilyl-N-(3-ethoxysilyl-3-ethylpentyl)-3-ethylpentan-1-amine
CID 157340694
3-(disulfanyl)-1,1,1-trifluoropropane
CID 87424751
6-ethoxysilyl-4,6-dimethylhept-3-en-1-amine
CID 173078593
1,1-bis(ethoxysilyl)ethyl acetate
CID 175177816
O-(2-ethoxysilylpropan-2-yl) ethanethioate
CID 154082675

Frequently Asked Questions

What is the IUPAC name of [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane?
The IUPAC name of [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane (CID 151651350) is [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane.
What is the SMILES notation for [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane?
The canonical SMILES for [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane is CCO[SiH2]C(C)(C)CCSS.
What is the InChIKey of [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane?
The InChIKey is QUOQRQMVRDSLQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18OS2Si/c1-4-8-11-7(2,3)5-6-10-9/h9H,4-6,11H2,1-3H3.
What are the key properties of [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane?
[4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane has a molecular weight of 210.44 g/mol, XLogP of 2.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(disulfanyl)-2-methylbutan-2-yl]-ethoxysilane is sourced from PubChem (CID 151651350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).