CAS
98294-08-7 Purity
96%
98294-08-7 Purity
96%
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6-Chloro-3-(1-methyl-4-piperidinyl)-1H-indazole
CAS
98295-18-2
Catalog Number
ACM98295182
Category
Other Products
Molecular Weight
249.739240 [g/mol]
Molecular Formula
C13H16ClN3
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Specification
Synonyms
1H-INDAZOLE, 6-CHLORO-3-(1-METHYL-4-PIPERIDINYL)-, SureCN10396274, AGN-PC-00070W, 6-chloro-3-(1-methylpiperidin-4-yl)-2H-indazole, 98295-18-2
IUPAC Name
6-chloro-3-(1-methylpiperidin-4-yl)-2H-indazole
InChI Key
CXPQMMRSFJHSER-UHFFFAOYSA-N
Exact Mass
249.10300
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 6-Chloro-3-(1-methyl-4-piperidinyl)-1H-indazole?
The molecular formula is C13H16ClN3.
When was the compound created and last modified?
The compound was created on 2007-02-09 and last modified on 2023-12-30.
What is the IUPAC name of the compound?
The IUPAC name is 6-chloro-3-(1-methylpiperidin-4-yl)-2H-indazole.
What is the InChI of the compound?
The InChI is InChI=1S/C13H16ClN3/c1-17-6-4-9(5-7-17)13-11-3-2-10(14)8-12(11)15-16-13/h2-3,8-9H,4-7H2,1H3,(H,15,16).
What is the InChIKey of the compound?
The InChIKey is CXPQMMRSFJHSER-UHFFFAOYSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES is CN1CCC(CC1)C2=C3C=CC(=CC3=NN2)Cl.
What is the molecular weight of the compound?
The molecular weight is 249.74 g/mol.
How many hydrogen bond donor counts does the compound have?
The compound has 1 hydrogen bond donor count.
How many hydrogen bond acceptor counts does the compound have?
The compound has 2 hydrogen bond acceptor counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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