CAS
98197-08-1 Purity
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98197-08-1 Purity
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1H-Pyrazole-5-carboxylicacid,4-chloro-1,3-dimethyl-
CAS
98198-65-3
Catalog Number
ACM98198653
Category
Other Products
Molecular Weight
174.58
Molecular Formula
C6H7ClN2O2
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Specification
Synonyms
ART-CHEM-BB B000151;4-CHLORO-2,5-DIMETHYL-2H-PYRAZOLE-3-CARBOXYLIC ACID;4-CHLORO-1,3-DIMETHYL-1H-PYRAZOLE-5-CARBOXYLIC ACID;AKOS B000151
What is the molecular formula of the compound?
The molecular formula of the compound is C6H7ClN2O2.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 4-chloro-2,5-dimethylpyrazole-3-carboxylic acid.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C6H7ClN2O2/c1-3-4(7)5(6(10)11)9(2)8-3/h1-2H3,(H,10,11).
What is the InChIKey of the compound?
The InChIKey of the compound is BSCNPVBDEITWDU-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is CC1=NN(C(=C1Cl)C(=O)O)C.
What is the molecular weight of the compound?
The molecular weight of the compound is 174.58 g/mol.
What is the CAS number of the compound?
The CAS number of the compound is 98198-65-3.
What is the EC number of the compound?
The EC number of the compound is 673-158-7.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 1.1.
Is the compound canonically represented?
Yes, the compound is canonically represented.
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