Ethyl 4,6-dichloro-2-(methylthio)pyrimidine-5-carboxylate

• CAS: 959070-42-9
• Catalog Number: ACM959070429
• Category: Other Products
• Molecular Weight: 267.132320 [g/mol]
• Molecular Formula: C8H8Cl2N2O2S
• Synonyms: ETHYL 4,6-DICHLORO-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLATE, 959070-42-9, AC1LBDOM, CTK6F5334, ANW-63406, AKOS015892474, Pyrimidine-5-carboxylic acid, 4,6-dichloro-2-(methylthio)-, ethyl ester, AG-K-88204, QC-9669, AK-82571, AB1000677, KB-253203, I03-0740, ethyl 4,6-dichloro-2-methylsulfanylpyrimidine-5-carboxylate, ethyl 4,6-dichloro-2-(methylsulfanyl)pyrimidine-5-carboxylate
• IUPAC Name: ethyl 4,6-dichloro-2-methylsulfanylpyrimidine-5-carboxylate
• Canonical SMILES: CCOC(=O)C1=C(N=C(N=C1Cl)SC)Cl
• InChI Key: HXNWMDJXIPNHBK-UHFFFAOYSA-N
• Exact Mass: 265.96800
• H-Bond Acceptor: 5
• H-Bond Donor: 0

Custom Q&A

What is the IUPAC name of the compound?

The IUPAC name of the compound is ethyl 4,6-dichloro-2-methylsulfanylpyrimidine-5-carboxylate.

What is the molecular formula of the compound?

The molecular formula of the compound is C8H8Cl2N2O2S.

What is the molecular weight of the compound?

The molecular weight of the compound is 267.13 g/mol.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C8H8Cl2N2O2S/c1-3-14-7(13)4-5(9)11-8(15-2)12-6(4)10/h3H2,1-2H3.

What is the InChIKey of the compound?

The InChIKey of the compound is HXNWMDJXIPNHBK-UHFFFAOYSA-N.

What is the CAS number of the compound?

The CAS number of the compound is 959070-42-9.

What is the European Community (EC) Number of the compound?

The European Community (EC) Number of the compound is 863-012-2.

What is the hydrogen bond donor count of the compound?

The hydrogen bond donor count of the compound is 0.

What is the hydrogen bond acceptor count of the compound?

The hydrogen bond acceptor count of the compound is 5.

Is the compound canonicalized?

Yes, the compound is canonicalized.