Cas no 665026-50-6 (5-Chloro-3-ethyl-1-(4-nitrophenyl)-1H-pyrazole)
665026-50-6 structure
Product Name:5-Chloro-3-ethyl-1-(4-nitrophenyl)-1H-pyrazole
CAS No:665026-50-6
MF:C11H10ClN3O2
MW:251.669001102448
CID:2795983
PubChem ID:66021747
Update Time:2025-04-21
5-Chloro-3-ethyl-1-(4-nitrophenyl)-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
-
- 665026-50-6
- DTXSID70734961
- 5-Chloro-3-ethyl-1-(4-nitrophenyl)-1H-pyrazole
- AKOS015364004
-
- Inchi： 1S/C11H10ClN3O2/c1-2-8-7-11(12)14(13-8)9-3-5-10(6-4-9)15(16)17/h3-7H,2H2,1H3
- InChI Key： FLVFAUDAISUSQC-UHFFFAOYSA-N
- SMILES： ClC1=CC(CC)=NN1C1C=CC(=CC=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 251.0461543Da
- Monoisotopic Mass: 251.0461543Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 276
- 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: 3.5
- Topological Polar Surface Area: 63.6?2
5-Chloro-3-ethyl-1-(4-nitrophenyl)-1H-pyrazole Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
665026-50-6 (5-Chloro-3-ethyl-1-(4-nitrophenyl)-1H-pyrazole) Related Products
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