Kaliumbenzylat

C7H7KO — CID 23672811

IUPACpotassium phenylmethanolate
SMILESC1=CC=C(C=C1)C[O-].[K+]
InChIInChI=1S/C7H7O.K/c8-6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1
InChIKeyBRZFUJPZZUJAKR-UHFFFAOYSA-N
MW146.23 g/mol
LogP—
Rot. Bonds1

About Kaliumbenzylat

Kaliumbenzylat (PubChem CID 23672811) has the molecular formula C7H7KO and a molecular weight of 146.23 g/mol. Its IUPAC name is potassium phenylmethanolate.

Molecular Properties

Compound NameKaliumbenzylat
PubChem CID23672811
Molecular FormulaC7H7KO
Molecular Weight146.23 g/mol
Exact Mass146.01
IUPAC Namepotassium phenylmethanolate
SMILESC1=CC=C(C=C1)C[O-].[K+]
InChIInChI=1S/C7H7O.K/c8-6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1
InChIKeyBRZFUJPZZUJAKR-UHFFFAOYSA-N
XLogP—
TPSA23.10 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity59

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of Kaliumbenzylat?
The IUPAC name of Kaliumbenzylat (CID 23672811) is potassium phenylmethanolate.
What is the SMILES notation for Kaliumbenzylat?
The canonical SMILES for Kaliumbenzylat is C1=CC=C(C=C1)C[O-].[K+].
What is the InChIKey of Kaliumbenzylat?
The InChIKey is BRZFUJPZZUJAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7O.K/c8-6-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1.
What are the key properties of Kaliumbenzylat?
Kaliumbenzylat has a molecular weight of 146.23 g/mol, XLogP of not available, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Kaliumbenzylat is sourced from PubChem (CID 23672811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).