(2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol

C8H20OSSi2 — CID 175382099

IUPAC(2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol
SMILESC[Si]1(C)CCC(CS)O[Si]1(C)C
InChIInChI=1S/C8H20OSSi2/c1-11(2)6-5-8(7-10)9-12(11,3)4/h8,10H,5-7H2,1-4H3
InChIKeyPAGVPRFGZNNIPN-UHFFFAOYSA-N
MW220.49 g/mol
LogP2.70
Rot. Bonds1

About (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol

(2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol (PubChem CID 175382099) has the molecular formula C8H20OSSi2 and a molecular weight of 220.49 g/mol. Its IUPAC name is (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol.

Molecular Properties

Compound Name(2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol
PubChem CID175382099
Molecular FormulaC8H20OSSi2
Molecular Weight220.49 g/mol
Exact Mass220.08
IUPAC Name(2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol
SMILESC[Si]1(C)CCC(CS)O[Si]1(C)C
InChIInChI=1S/C8H20OSSi2/c1-11(2)6-5-8(7-10)9-12(11,3)4/h8,10H,5-7H2,1-4H3
InChIKeyPAGVPRFGZNNIPN-UHFFFAOYSA-N
XLogP2.70
TPSA9.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.49
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,2,3,3-tetramethyl-6-(oxiran-2-ylmethyl)oxadisilinane
CID 175506003
4-(2,2,3,3-tetramethyloxadisilinan-6-yl)but-2-ynenitrile
CID 175548328
lithium;hydride;2,2,3,3,6-pentamethyloxadisilinane
CID 175145589
2,2,6-triethyl-3,3-dimethyloxadisilinane
CID 175106629
1-(2,2,3,3-tetramethyloxadisilinan-6-yl)butan-1-ol
CID 68832870
3-(2,2-dimethyl-3,3-diphenyloxadisilinan-6-yl)propan-1-amine
CID 174867095
3-chloro-2,2,3,6-tetramethyloxadisilinane
CID 175582172
6-(chloromethyl)-2,2-dimethyloxasilinane
CID 174565435
2,2,3,3-tetramethyl-6,6-bis[3-(oxiran-2-ylmethoxy)propyl]oxadisilinane
CID 87580105
1-(2,2-dimethyloxasilinan-6-yl)propane-1-thiol
CID 88829184
6-ethyl-2-methyloxasilinane-2-carbonitrile
CID 18974160
2-(2,2,3,3,6-pentamethyloxadisilinan-6-yl)acetonitrile
CID 70563507

Frequently Asked Questions

What is the IUPAC name of (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol?
The IUPAC name of (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol (CID 175382099) is (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol.
What is the SMILES notation for (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol?
The canonical SMILES for (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol is C[Si]1(C)CCC(CS)O[Si]1(C)C.
What is the InChIKey of (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol?
The InChIKey is PAGVPRFGZNNIPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20OSSi2/c1-11(2)6-5-8(7-10)9-12(11,3)4/h8,10H,5-7H2,1-4H3.
What are the key properties of (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol?
(2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol has a molecular weight of 220.49 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2,3,3-tetramethyloxadisilinan-6-yl)methanethiol is sourced from PubChem (CID 175382099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).