methyl cyclohexylmethanesulfinate;yttrium

C8H15O2SY- — CID 158140284

IUPACmethyl cyclohexylmethanesulfinate;yttrium
SMILESCOS(=O)CC1CC[CH-]CC1.[Y]
InChIInChI=1S/C8H15O2S.Y/c1-10-11(9)7-8-5-3-2-4-6-8;/h2,8H,3-7H2,1H3;/q-1;
InChIKeyGNKDXSHJLWDAQK-UHFFFAOYSA-N
MW264.18 g/mol
LogP1.69
Rot. Bonds3

About methyl cyclohexylmethanesulfinate;yttrium

methyl cyclohexylmethanesulfinate;yttrium (PubChem CID 158140284) has the molecular formula C8H15O2SY- and a molecular weight of 264.18 g/mol. Its IUPAC name is methyl cyclohexylmethanesulfinate;yttrium.

Molecular Properties

Compound Namemethyl cyclohexylmethanesulfinate;yttrium
PubChem CID158140284
Molecular FormulaC8H15O2SY-
Molecular Weight264.18 g/mol
Exact Mass263.99
IUPAC Namemethyl cyclohexylmethanesulfinate;yttrium
SMILESCOS(=O)CC1CC[CH-]CC1.[Y]
InChIInChI=1S/C8H15O2S.Y/c1-10-11(9)7-8-5-3-2-4-6-8;/h2,8H,3-7H2,1H3;/q-1;
InChIKeyGNKDXSHJLWDAQK-UHFFFAOYSA-N
XLogP1.69
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.18
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl cyclohexylmethanesulfinate;yttrium?
The IUPAC name of methyl cyclohexylmethanesulfinate;yttrium (CID 158140284) is methyl cyclohexylmethanesulfinate;yttrium.
What is the SMILES notation for methyl cyclohexylmethanesulfinate;yttrium?
The canonical SMILES for methyl cyclohexylmethanesulfinate;yttrium is COS(=O)CC1CC[CH-]CC1.[Y].
What is the InChIKey of methyl cyclohexylmethanesulfinate;yttrium?
The InChIKey is GNKDXSHJLWDAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15O2S.Y/c1-10-11(9)7-8-5-3-2-4-6-8;/h2,8H,3-7H2,1H3;/q-1;.
What are the key properties of methyl cyclohexylmethanesulfinate;yttrium?
methyl cyclohexylmethanesulfinate;yttrium has a molecular weight of 264.18 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl cyclohexylmethanesulfinate;yttrium is sourced from PubChem (CID 158140284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).