methanethiolate;2-methylpropane;yttrium

C5H12SY-2 — CID 164848355

IUPACmethanethiolate;2-methylpropane;yttrium
SMILESC[C-](C)C.C[S-].[Y]
InChIInChI=1S/C4H9.CH4S.Y/c1-4(2)3;1-2;/h1-3H3;2H,1H3;/q-1;;/p-1
InChIKeyRSLJFYVJIYTVLK-UHFFFAOYSA-M
MW193.12 g/mol
LogP1.78
Rot. Bonds

About methanethiolate;2-methylpropane;yttrium

methanethiolate;2-methylpropane;yttrium (PubChem CID 164848355) has the molecular formula C5H12SY-2 and a molecular weight of 193.12 g/mol. Its IUPAC name is methanethiolate;2-methylpropane;yttrium.

Molecular Properties

Compound Namemethanethiolate;2-methylpropane;yttrium
PubChem CID164848355
Molecular FormulaC5H12SY-2
Molecular Weight193.12 g/mol
Exact Mass192.97
IUPAC Namemethanethiolate;2-methylpropane;yttrium
SMILESC[C-](C)C.C[S-].[Y]
InChIInChI=1S/C4H9.CH4S.Y/c1-4(2)3;1-2;/h1-3H3;2H,1H3;/q-1;;/p-1
InChIKeyRSLJFYVJIYTVLK-UHFFFAOYSA-M
XLogP1.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.12
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methanethiolate;2-methylpropane;yttrium?
The IUPAC name of methanethiolate;2-methylpropane;yttrium (CID 164848355) is methanethiolate;2-methylpropane;yttrium.
What is the SMILES notation for methanethiolate;2-methylpropane;yttrium?
The canonical SMILES for methanethiolate;2-methylpropane;yttrium is C[C-](C)C.C[S-].[Y].
What is the InChIKey of methanethiolate;2-methylpropane;yttrium?
The InChIKey is RSLJFYVJIYTVLK-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9.CH4S.Y/c1-4(2)3;1-2;/h1-3H3;2H,1H3;/q-1;;/p-1.
What are the key properties of methanethiolate;2-methylpropane;yttrium?
methanethiolate;2-methylpropane;yttrium has a molecular weight of 193.12 g/mol, XLogP of 1.78, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanethiolate;2-methylpropane;yttrium is sourced from PubChem (CID 164848355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).