5-(1-Methylethyl)-1-phenyl-1H-pyrazole-4-carboxylic acid
CAS Registry Number®
116344-18-4
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CAS Name
5-(1-Methylethyl)-1-phenyl-1H-pyrazole-4-carboxylic acidMolecular Formula
C13H14N2O2Molecular Mass
230.26Cite this Page
5-(1-Methylethyl)-1-phenyl-1H-pyrazole-4-carboxylic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=116344-18-4 (retrieved ) (CAS RN: 116344-18-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
168 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
Other Names and Identifiers
InChI
InChI=1S/C13H14N2O2/c1-9(2)12-11(13(16)17)8-14-15(12)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,16,17)
InChIKey
InChIKey=MQUOHNQYSXJILW-UHFFFAOYSA-N
SMILES
C(C)(C)C=1N(N=CC1C(O)=O)C2=CC=CC=C2
Canonical SMILES
O=C(O)C=1C=NN(C=2C=CC=CC2)C1C(C)C
Other Names for this Substance
- 1H-Pyrazole-4-carboxylic acid, 5-(1-methylethyl)-1-phenyl-
- 5-(1-Methylethyl)-1-phenyl-1H-pyrazole-4-carboxylic acid
- 1-Phenyl-5-(propan-2-yl)-1H-pyrazole-4-carboxylic acid
