cesium 2-methoxyphenolate

C7H7CsO2 — CID 23674354

IUPACcesium 2-methoxyphenolate
SMILESCOc1ccccc1[O-].[Cs+]
InChIInChI=1S/C7H8O2.Cs/c1-9-7-5-3-2-4-6(7)8;/h2-5,8H,1H3;/q;+1/p-1
InChIKeyXIPSHVDSLMAQNR-UHFFFAOYSA-M
MW256.04 g/mol
LogP-2.23
Rot. Bonds1

About cesium 2-methoxyphenolate

cesium 2-methoxyphenolate (PubChem CID 23674354) has the molecular formula C7H7CsO2 and a molecular weight of 256.04 g/mol. Its IUPAC name is cesium 2-methoxyphenolate.

Molecular Properties

Compound Namecesium 2-methoxyphenolate
PubChem CID23674354
Molecular FormulaC7H7CsO2
Molecular Weight256.04 g/mol
Exact Mass255.95
IUPAC Namecesium 2-methoxyphenolate
SMILESCOc1ccccc1[O-].[Cs+]
InChIInChI=1S/C7H8O2.Cs/c1-9-7-5-3-2-4-6(7)8;/h2-5,8H,1H3;/q;+1/p-1
InChIKeyXIPSHVDSLMAQNR-UHFFFAOYSA-M
XLogP-2.23
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.04
LogP ≤ 5-2.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cesium 2-methoxyphenolate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

azane;1,2-dimethoxybenzene
CID 174437926
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
1,2-dimethoxybenzene;molecular nitrogen;hydrochloride
CID 173306958
sodium 2-ethoxyphenolate
CID 23671657
2-[oxido-bis(2-oxidophenoxy)phosphaniumyl]oxyphenolate
CID 102466013
(2-methoxyphenyl)boronic acid
CID 2733958
magnesium;(2-methoxyphenyl)-dimethyl-oxidosilane;chloride
CID 153323753
2-(2-methoxyphenyl)-1,3-selenazole
CID 87779357
azane;2-methoxyphenol
CID 172717837
1-chloro-2-methoxybenzene
CID 13011
potassium 2-methoxy-6-methylphenolate
CID 23697488
lithium bis(2-methoxyphenyl)phosphinite
CID 22052788

Frequently Asked Questions

What is the IUPAC name of cesium 2-methoxyphenolate?
The IUPAC name of cesium 2-methoxyphenolate (CID 23674354) is cesium 2-methoxyphenolate.
What is the SMILES notation for cesium 2-methoxyphenolate?
The canonical SMILES for cesium 2-methoxyphenolate is COc1ccccc1[O-].[Cs+].
What is the InChIKey of cesium 2-methoxyphenolate?
The InChIKey is XIPSHVDSLMAQNR-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H8O2.Cs/c1-9-7-5-3-2-4-6(7)8;/h2-5,8H,1H3;/q;+1/p-1.
What are the key properties of cesium 2-methoxyphenolate?
cesium 2-methoxyphenolate has a molecular weight of 256.04 g/mol, XLogP of -2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cesium 2-methoxyphenolate is sourced from PubChem (CID 23674354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).