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Structure

4-Chloro-6-(trifluoromethyl)pyrimidine

CAS
37552-81-1
Catalog Number
ACM37552811
Category
Main Products
Molecular Weight
182.53
Molecular Formula
C5H2ClF3N2

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Specification

Synonyms
4-chloro-6-(trifluoromethyl)pyrimidine; 4-Chloro-6-(trifluoromethyl)pyrimidine;
IUPAC Name
4-chloro-6-(trifluoromethyl)pyrimidine
Canonical SMILES
C1=C(N=CN=C1Cl)C(F)(F)F
InChI Key
TYSPDLZOMUDHQZ-UHFFFAOYSA-N
Boiling Point
166.9ºC at 760mmHg
Flash Point
54.7ºC
Density
1.504g/cm³
Exact Mass
181.98600
Safety Description
26-36/37/39
What is the molecular formula of 4-Chloro-6-(trifluoromethyl)pyrimidine?

The molecular formula is C5H2ClF3N2.

What are the synonyms for 4-Chloro-6-(trifluoromethyl)pyrimidine?

The synonyms include 4-chloro-6-(trifluoromethyl)pyrimidine, 4-Chloro-6-trifluoromethylpyrimidine, and 4-Chloro-6-trifluoromethyl-pyrimidine, among others.

What is the CAS number of 4-Chloro-6-(trifluoromethyl)pyrimidine?

The CAS number is 37552-81-1.

What is the IUPAC name of 4-Chloro-6-(trifluoromethyl)pyrimidine?

The IUPAC name is 4-chloro-6-(trifluoromethyl)pyrimidine.

What is the InChIKey of 4-Chloro-6-(trifluoromethyl)pyrimidine?

The InChIKey is TYSPDLZOMUDHQZ-UHFFFAOYSA-N.

What is the molecular weight of 4-Chloro-6-(trifluoromethyl)pyrimidine?

The molecular weight is 182.53 g/mol.

How many hydrogen bond acceptor counts does 4-Chloro-6-(trifluoromethyl)pyrimidine have?

It has 5 hydrogen bond acceptor counts.

What is the topological polar surface area of 4-Chloro-6-(trifluoromethyl)pyrimidine?

The topological polar surface area is 25.8 Ų.

How many rotatable bond counts does 4-Chloro-6-(trifluoromethyl)pyrimidine have?

It has 0 rotatable bond counts.

Is 4-Chloro-6-(trifluoromethyl)pyrimidine a canonicalized compound?

Yes, it is a canonicalized compound.

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