Structure

4-Chloro-2-fluorobenzoic acid

CAS
446-30-0
Catalog Number
ACM446300
Category
Aryl Fluorinated Building Blocks
Molecular Weight
174.56
Molecular Formula
C7H4ClFO2

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Specification

Synonyms
Benzoic acid, 4-chloro-2-fluoro-
IUPAC Name
4-chloro-2-fluorobenzoic acid
Canonical SMILES
C1=CC(=C(C=C1Cl)F)C(=O)O
InChI
InChI=1S/C7H4ClFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)
InChI Key
ZLPXBWMVZANJJQ-UHFFFAOYSA-N
Boiling Point
274.7±20.0 ºC
Melting Point
204-208 ºC (lit.)
Density
1.401 g/ml
Hazard Statements
H315-H319-H335
RIDADR
UN 3265 8 / PGII
Symbol
GHS07
What is the molecular formula of 4-Chloro-2-fluorobenzoic acid?

The molecular formula of 4-Chloro-2-fluorobenzoic acid is C7H4ClFO2.

What is the molecular weight of 4-Chloro-2-fluorobenzoic acid?

The molecular weight of 4-Chloro-2-fluorobenzoic acid is 174.55 g/mol.

What is the IUPAC name of 4-Chloro-2-fluorobenzoic acid?

The IUPAC name of 4-Chloro-2-fluorobenzoic acid is 4-chloro-2-fluorobenzoic acid.

What is the InChI of 4-Chloro-2-fluorobenzoic acid?

The InChI of 4-Chloro-2-fluorobenzoic acid is InChI=1S/C7H4ClFO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11).

What is the InChIKey of 4-Chloro-2-fluorobenzoic acid?

The InChIKey of 4-Chloro-2-fluorobenzoic acid is ZLPXBWMVZANJJQ-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Chloro-2-fluorobenzoic acid?

The canonical SMILES of 4-Chloro-2-fluorobenzoic acid is C1=CC(=C(C=C1Cl)F)C(=O)O.

What is the CAS number of 4-Chloro-2-fluorobenzoic acid?

The CAS number of 4-Chloro-2-fluorobenzoic acid is 446-30-0.

What is the UNII of 4-Chloro-2-fluorobenzoic acid?

The UNII of 4-Chloro-2-fluorobenzoic acid is MU5ZEU8Q5V.

Is 4-Chloro-2-fluorobenzoic acid a canonical compound?

Yes, 4-Chloro-2-fluorobenzoic acid is a canonical compound.

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