2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum

C8H8FLa- — CID 173481982

IUPAC2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum
SMILESCc1c[c-]c(C)c(F)c1.[La]
InChIInChI=1S/C8H8F.La/c1-6-3-4-7(2)8(9)5-6;/h3,5H,1-2H3;/q-1;
InChIKeyYJCLHEJQJRSHSB-UHFFFAOYSA-N
MW262.06 g/mol
LogP2.24
Rot. Bonds

About 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum

2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum (PubChem CID 173481982) has the molecular formula C8H8FLa- and a molecular weight of 262.06 g/mol. Its IUPAC name is 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum.

Molecular Properties

Compound Name2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum
PubChem CID173481982
Molecular FormulaC8H8FLa-
Molecular Weight262.06 g/mol
Exact Mass261.97
IUPAC Name2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum
SMILESCc1c[c-]c(C)c(F)c1.[La]
InChIInChI=1S/C8H8F.La/c1-6-3-4-7(2)8(9)5-6;/h3,5H,1-2H3;/q-1;
InChIKeyYJCLHEJQJRSHSB-UHFFFAOYSA-N
XLogP2.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.06
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum?
The IUPAC name of 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum (CID 173481982) is 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum.
What is the SMILES notation for 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum?
The canonical SMILES for 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum is Cc1c[c-]c(C)c(F)c1.[La].
What is the InChIKey of 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum?
The InChIKey is YJCLHEJQJRSHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F.La/c1-6-3-4-7(2)8(9)5-6;/h3,5H,1-2H3;/q-1;.
What are the key properties of 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum?
2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum has a molecular weight of 262.06 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1,4-dimethylbenzene-6-ide;lanthanum is sourced from PubChem (CID 173481982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).