Cas no 90145-36-1 (1H-Pyrazole-5-carboxylic acid, 1-methyl-3,4-diphenyl-)
90145-36-1 structure
Product Name:1H-Pyrazole-5-carboxylic acid, 1-methyl-3,4-diphenyl-
CAS No:90145-36-1
MF:C17H14N2O2
MW:278.305263996124
CID:793236
PubChem ID:71307605
Update Time:2025-04-19
1H-Pyrazole-5-carboxylic acid, 1-methyl-3,4-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-5-carboxylic acid, 1-methyl-3,4-diphenyl-
- 2-methyl-4,5-diphenylpyrazole-3-carboxylic acid
- 90145-36-1
- 1-Methyl-3,4-diphenyl-1H-pyrazole-5-carboxylic acid
- J-504926
- DTXSID40745408
-
- Inchi： 1S/C17H14N2O2/c1-19-16(17(20)21)14(12-8-4-2-5-9-12)15(18-19)13-10-6-3-7-11-13/h2-11H,1H3,(H,20,21)
- InChI Key： DQWJJMCFBKQSGZ-UHFFFAOYSA-N
- SMILES： OC(C1=C(C2C=CC=CC=2)C(C2C=CC=CC=2)=NN1C)=O
Computed Properties
- Exact Mass: 278.105527694g/mol
- Monoisotopic Mass: 278.105527694g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 362
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 55.1?2
1H-Pyrazole-5-carboxylic acid, 1-methyl-3,4-diphenyl- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
90145-36-1 (1H-Pyrazole-5-carboxylic acid, 1-methyl-3,4-diphenyl-) Related Products
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