CAS
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2-Fluoro-4-methylbenzonitrile
Catalog Number
ACMA00001956
Category
Aryl Fluorinated Building Blocks
Molecular Weight
135.14
Molecular Formula
C8H6ClFO2
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Specification
Hazard Statements
H302
RIDADR
UN 2811 6.1 / PGIII
Symbol
GHS07
What is the molecular formula of 2-Fluoro-4-methylbenzonitrile?
The molecular formula of 2-Fluoro-4-methylbenzonitrile is C8H6FN.
When was 2-Fluoro-4-methylbenzonitrile created in PubChem?
2-Fluoro-4-methylbenzonitrile was created on July 19, 2005.
What is the molecular weight of 2-Fluoro-4-methylbenzonitrile?
The molecular weight of 2-Fluoro-4-methylbenzonitrile is 135.14 g/mol.
What is the InChIKey of 2-Fluoro-4-methylbenzonitrile?
The InChIKey of 2-Fluoro-4-methylbenzonitrile is WCGNLBCJPBKXCN-UHFFFAOYSA-N.
What is the Canonical SMILES representation of 2-Fluoro-4-methylbenzonitrile?
The Canonical SMILES representation of 2-Fluoro-4-methylbenzonitrile is CC1=CC(=C(C=C1)C#N)F.
What is the European Community (EC) Number for 2-Fluoro-4-methylbenzonitrile?
The European Community (EC) Number for 2-Fluoro-4-methylbenzonitrile is 678-781-8.
What is the XLogP3-AA value for 2-Fluoro-4-methylbenzonitrile?
The XLogP3-AA value for 2-Fluoro-4-methylbenzonitrile is 2.1.
How many hydrogen bond acceptors does 2-Fluoro-4-methylbenzonitrile have?
2-Fluoro-4-methylbenzonitrile has 2 hydrogen bond acceptors.
What is the topological polar surface area of 2-Fluoro-4-methylbenzonitrile?
The topological polar surface area of 2-Fluoro-4-methylbenzonitrile is 23.8 Å2.
Is 2-Fluoro-4-methylbenzonitrile a canonicalized compound?
Yes, 2-Fluoro-4-methylbenzonitrile is a canonicalized compound according to PubChem.
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