CAS
959070-83-8 Purity
96%
959070-83-8 Purity
96%
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4,5-Dihydro-1-(4-methylphenyl)-3-phenyl-1H-pyrazole
CAS
959-08-0
Catalog Number
ACM959080
Category
Other Products
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What is the molecular formula of the compound?
The molecular formula is C16H16N2.
What is the molecular weight of the compound?
The molecular weight is 236.31 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 2-(4-methylphenyl)-5-phenyl-3,4-dihydropyrazole.
What is the InChI of the compound?
The InChI is InChI=1S/C16H16N2/c1-13-7-9-15(10-8-13)18-12-11-16(17-18)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3.
What is the InChIKey of the compound?
The InChIKey is AYHPHTPTBNMSGC-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is CC1=CC=C(C=C1)N2CCC(=N2)C3=CC=CC=C3.
What is the CAS number of the compound?
The CAS number is 959-08-0.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.9.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
How many rotatable bond counts does the compound have?
The compound has 2 rotatable bond counts.
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