methanol;tetramethylazanium;chloride

C5H16ClNO — CID 18968276

IUPACmethanol;tetramethylazanium;chloride
SMILESCO.C[N+](C)(C)C.[Cl-]
InChIInChI=1S/C4H12N.CH4O.ClH/c1-5(2,3)4;1-2;/h1-4H3;2H,1H3;1H/q+1;;/p-1
InChIKeyYLRAQZINGDSCCK-UHFFFAOYSA-M
MW141.64 g/mol
LogP-3.07
Rot. Bonds

About methanol;tetramethylazanium;chloride

methanol;tetramethylazanium;chloride (PubChem CID 18968276) has the molecular formula C5H16ClNO and a molecular weight of 141.64 g/mol. Its IUPAC name is methanol;tetramethylazanium;chloride.

Molecular Properties

Compound Namemethanol;tetramethylazanium;chloride
PubChem CID18968276
Molecular FormulaC5H16ClNO
Molecular Weight141.64 g/mol
Exact Mass141.09
IUPAC Namemethanol;tetramethylazanium;chloride
SMILESCO.C[N+](C)(C)C.[Cl-]
InChIInChI=1S/C4H12N.CH4O.ClH/c1-5(2,3)4;1-2;/h1-4H3;2H,1H3;1H/q+1;;/p-1
InChIKeyYLRAQZINGDSCCK-UHFFFAOYSA-M
XLogP-3.07
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.64
LogP ≤ 5-3.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methanol;tetramethylazanium;chloride?
The IUPAC name of methanol;tetramethylazanium;chloride (CID 18968276) is methanol;tetramethylazanium;chloride.
What is the SMILES notation for methanol;tetramethylazanium;chloride?
The canonical SMILES for methanol;tetramethylazanium;chloride is CO.C[N+](C)(C)C.[Cl-].
What is the InChIKey of methanol;tetramethylazanium;chloride?
The InChIKey is YLRAQZINGDSCCK-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H12N.CH4O.ClH/c1-5(2,3)4;1-2;/h1-4H3;2H,1H3;1H/q+1;;/p-1.
What are the key properties of methanol;tetramethylazanium;chloride?
methanol;tetramethylazanium;chloride has a molecular weight of 141.64 g/mol, XLogP of -3.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;tetramethylazanium;chloride is sourced from PubChem (CID 18968276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).