CAS
98806-82-7 Purity
96%
98806-82-7 Purity
96%
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4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine
CAS
98814-28-9
Catalog Number
ACM98814289
Category
Other Products
Molecular Weight
241.095040 [g/mol]
Molecular Formula
C6H6Cl2N2O2S
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Specification
Synonyms
4,6-Dichloro-5-methyl-2-(methylsulfonyl)pyrimidine, 98814-28-9, AKOS016012272, AK122868, KB-239574
IUPAC Name
4,6-dichloro-5-methyl-2-methylsulfonylpyrimidine
Canonical SMILES
CC1=C(N=C(N=C1Cl)S(=O)(=O)C)Cl
InChI Key
PFBXJKYMQNTIEN-UHFFFAOYSA-N
Exact Mass
239.95300
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The molecular formula is C6H6Cl2N2O2S.
What is the PubChem CID of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The PubChem CID is 57757768.
What is the IUPAC name of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The IUPAC name is 4,6-dichloro-5-methyl-2-methylsulfonylpyrimidine.
What is the InChI of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The InChI is InChI=1S/C6H6Cl2N2O2S/c1-3-4(7)9-6(10-5(3)8)13(2,11)12/h1-2H3.
What is the InChIKey of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The InChIKey is PFBXJKYMQNTIEN-UHFFFAOYSA-N.
What is the molecular weight of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The molecular weight is 241.09 g/mol.
What is the CAS number of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The CAS number is 98814-28-9.
What is the XLogP3-AA value of 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine?
The XLogP3-AA value is 2.1.
How many hydrogen bond acceptor counts does 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine have?
It has 4 hydrogen bond acceptor counts.
Is 4,6-Dichloro-5-methyl-2-(methylsulfonyl)-pyrimidine a canonicalized compound?
Yes, it is a canonicalized compound.
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