2-(Methylthio)pyrimidine-5-carbaldehyde

CAS
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Purity
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CAS
90905-31-0
Size
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Purity
97%
Price
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Availability
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Catalog Number

ACM90905310

Product Name

2-(Methylthio)pyrimidine-5-carbaldehyde

Structure

Structure

CAS

90905-31-0

Category

Heterocyclic Organic Compound

Synonyms

ZINC04553869, ZERO/009841, CID3151865, 2-(Methylthio)pyrimidine-5-carbaldehyde, BAS 05215236, 2-Methylsulfanyl-pyrimidine-5-carbaldehyde, 90905-31-0

IUPAC Name

2-methylsulfanylpyrimidine-5-carbaldehyde

Molecular Weight

154.19

Molecular Formula

C₆H₆N₂OS

InChI Key

OERITKQWELOJBM-UHFFFAOYSA-N

Boiling Point

301.2ºC at 760mmHg

Flash Point

136ºC

Density

1.29g/cm³

Exact Mass

154.02000

Hazard Statements

Xi: Irritant;

H-Bond Acceptor

3

H-Bond Donor

0

MSDS

COA

Spec Sheet

Download Spec Sheet

What is the molecular formula of 2-(Methylthio)pyrimidine-5-carbaldehyde?

The molecular formula is C6H6N2OS.

What is the molecular weight of 2-(Methylthio)pyrimidine-5-carbaldehyde?

The molecular weight is 154.19 g/mol.

What is the IUPAC name of 2-(Methylthio)pyrimidine-5-carbaldehyde?

The IUPAC name is 2-methylsulfanylpyrimidine-5-carbaldehyde.

What is the InChIKey of 2-(Methylthio)pyrimidine-5-carbaldehyde?

The InChIKey is OERITKQWELOJBM-UHFFFAOYSA-N.

What is the Canonical SMILES of 2-(Methylthio)pyrimidine-5-carbaldehyde?

The Canonical SMILES is CSC1=NC=C(C=N1)C=O.

What is the CAS number for 2-(Methylthio)pyrimidine-5-carbaldehyde?

The CAS number is 90905-31-0.

How many hydrogen bond donor counts does 2-(Methylthio)pyrimidine-5-carbaldehyde have?

It has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 2-(Methylthio)pyrimidine-5-carbaldehyde have?

It has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 2-(Methylthio)pyrimidine-5-carbaldehyde?

The topological polar surface area is 68.2 Å².

Is 2-(Methylthio)pyrimidine-5-carbaldehyde a canonicalized compound?

Yes, it is a canonicalized compound.

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