Structure

4,5-Dichlorophthalic acid

CAS
56962-08-4
Catalog Number
ACM56962084
Category
Polymer/Macromolecule
Molecular Weight
235.02
Molecular Formula
C8H4Cl2O4

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Specification

Synonyms
4,5-dichloro-2-benzenedicarboxylicacid;DICHLOROPHTHALIC ACID;AKOS 92369;4,5-DICHLOROPHTHALIC ACID;RARECHEM AL BO 0785;4 5-DICHLOROPHTHALIC ACID97%(HPLC);4,5-Dichlorophthalicacid,99%;4,5-DICHLOROPHTHALIC ACID 99%
IUPAC Name
4,5-dichlorophthalic acid
Canonical SMILES
C1=C(C(=CC(=C1Cl)Cl)C(=O)O)C(=O)O
InChI Key
FDOQKGWUMUEJLX-UHFFFAOYSA-N
Boiling Point
422.1ºC at 760mmHg
Melting Point
198-200ºC (dec.)(lit.)
Flash Point
209.1ºC
Density
1.698g/cm³
EC Number
260-478-3
Exact Mass
233.94900
Hazard Statements
Xi
H-Bond Acceptor
4
H-Bond Donor
2
Safety Description
S24/25
WGK Germany
3
What is the molecular formula of 4,5-Dichlorophthalic acid?

The molecular formula of 4,5-Dichlorophthalic acid is C8H4Cl2O4.

What is the molecular weight of 4,5-Dichlorophthalic acid?

The molecular weight of 4,5-Dichlorophthalic acid is 235.02 g/mol.

What is the IUPAC name of 4,5-Dichlorophthalic acid?

The IUPAC name of 4,5-Dichlorophthalic acid is 4,5-dichlorophthalic acid.

What is the InChIKey of 4,5-Dichlorophthalic acid?

The InChIKey of 4,5-Dichlorophthalic acid is FDOQKGWUMUEJLX-UHFFFAOYSA-N.

How many hydrogen bond donor counts are there in 4,5-Dichlorophthalic acid?

There are 2 hydrogen bond donor counts in 4,5-Dichlorophthalic acid.

What is the exact mass of 4,5-Dichlorophthalic acid?

The exact mass of 4,5-Dichlorophthalic acid is 233.9486640 g/mol.

How many topological polar surface areas does 4,5-Dichlorophthalic acid have?

4,5-Dichlorophthalic acid has a topological polar surface area of 74.6Ų.

How many heavy atoms are present in 4,5-Dichlorophthalic acid?

There are 14 heavy atoms present in 4,5-Dichlorophthalic acid.

Is the compound canonicalized in 4,5-Dichlorophthalic acid?

Yes, the compound is canonicalized in 4,5-Dichlorophthalic acid.

What is the complexity value of 4,5-Dichlorophthalic acid?

The complexity value of 4,5-Dichlorophthalic acid is 230.

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