2,4,6-Trichloropyrimidine-5-carboxylic acid

CAS

93416-51-4

Catalog Number

ACM93416514

Category

Other Products

Molecular Weight

227.432640 [g/mol]

Molecular Formula

C₅HCl₃N₂O₂

MSDS COA Spec Sheet

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Specification

Synonyms

2,4,6-Trichloropyrimidine-5-carboxylic acid, 93416-51-4, CTK5H2473, MolPort-019-879-275, AKOS016015046, AB55015, AG-I-03367, HP22996, AK-76016, KB-44098, TRICHLOROPYRIMIDINE-5-CARBOXYLIC ACID, 5-Pyrimidinecarboxylic acid,2,4,6-trichloro-, 2,4,6-TRICHLORO-5-PYRIMIDINE CARBOXYLIC ACID, 5-PYRIMIDINECARBOXYLIC ACID, 2,4,6-TRICHLORO-

IUPAC Name

2,4,6-trichloropyrimidine-5-carboxylic acid

Canonical SMILES

C1(=C(N=C(N=C1Cl)Cl)Cl)C(=O)O

InChI Key

WYOSARQXNFQQIG-UHFFFAOYSA-N

Exact Mass

225.91000

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 2,4,6-Trichloropyrimidine-5-carboxylic acid?

The molecular formula of 2,4,6-Trichloropyrimidine-5-carboxylic acid is C5HCl3N2O2.

When was 2,4,6-Trichloropyrimidine-5-carboxylic acid first created?

2,4,6-Trichloropyrimidine-5-carboxylic acid was first created on December 5, 2007.

What is the molecular weight of 2,4,6-Trichloropyrimidine-5-carboxylic acid?

The molecular weight of 2,4,6-Trichloropyrimidine-5-carboxylic acid is 227.43 g/mol.

What is the InChIKey of 2,4,6-Trichloropyrimidine-5-carboxylic acid?

The InChIKey of 2,4,6-Trichloropyrimidine-5-carboxylic acid is WYOSARQXNFQQIG-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 2,4,6-Trichloropyrimidine-5-carboxylic acid have?

2,4,6-Trichloropyrimidine-5-carboxylic acid has 1 hydrogen bond donor count.

What is the XLogP3-AA value of 2,4,6-Trichloropyrimidine-5-carboxylic acid?

The XLogP3-AA value of 2,4,6-Trichloropyrimidine-5-carboxylic acid is 2.6.

What is the exact mass of 2,4,6-Trichloropyrimidine-5-carboxylic acid?

The exact mass of 2,4,6-Trichloropyrimidine-5-carboxylic acid is 225.910360 g/mol.

How many hydrogen bond acceptor counts does 2,4,6-Trichloropyrimidine-5-carboxylic acid have?

2,4,6-Trichloropyrimidine-5-carboxylic acid has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 2,4,6-Trichloropyrimidine-5-carboxylic acid?

The topological polar surface area of 2,4,6-Trichloropyrimidine-5-carboxylic acid is 63.1 Å².

Is 2,4,6-Trichloropyrimidine-5-carboxylic acid a canonical compound?

Yes, 2,4,6-Trichloropyrimidine-5-carboxylic acid is a canonical compound.

Upstream Synthesis Route 1

50270-27-4

93416-51-4

Reference: [1]Patent: US4507146,1985,A

Upstream Synthesis Route 2

1780-36-5

93416-51-4

Reference: [1]Patent: US4507146,1985,A