CAS
99495-92-8 Purity
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99495-92-8 Purity
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1-Phenyl-3-(trifluoromethyl)-1H-pyrazole
CAS
99498-65-4
Catalog Number
ACM99498654
Category
Other Products
Molecular Weight
212.17
Molecular Formula
C10H7F3N2
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Specification
Synonyms
1-phenyl-3-(trifluoromethyl)pyrazole, 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole, 99498-65-4, 1H-Pyrazole, 1-phenyl-3-(trifluoromethyl)-, AC1MCQZB, ACMC-20aag5, SureCN1094013, CTK3F1155, MolPort-001-773-266, ANW-64467, PC2792, SBB094611, ZINC02243133, AKOS009158655, AG-A-21140, AK103800, KB-219675
IUPAC Name
1-phenyl-3-(trifluoromethyl)pyrazole
Canonical SMILES
C1=CC=C(C=C1)N2C=CC(=N2)C(F)(F)F
InChI Key
AKPVEJBNHMWPEC-UHFFFAOYSA-N
Exact Mass
212.05600
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole?
The molecular formula is C10H7F3N2.
When was 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole first created?
It was first created on July 19, 2005.
What is the IUPAC name of 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole?
The IUPAC name is 1-phenyl-3-(trifluoromethyl)pyrazole.
How many hydrogen bond acceptors does 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole have?
It has 4 hydrogen bond acceptors.
What is the exact mass of 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole?
The exact mass is 212.05613272 g/mol.
What is the topological polar surface area of 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole?
The topological polar surface area is 17.8 Ų.
How many heavy atoms are present in 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole?
There are 15 heavy atoms.
Does 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole have any defined atom stereocenters?
No, it does not have any defined atom stereocenters.
What is the XLogP3-AA value of 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole?
The XLogP3-AA value is 2.8.
Is 1-Phenyl-3-(trifluoromethyl)-1H-pyrazole a canonicalized compound according to PubChem?
Yes, it is a canonicalized compound.
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CAS
99499-25-9 Purity
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99499-25-9 Purity
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