Cas no 54415-28-0 (Methyl 2h-phenanthro[9,10-c]pyrazole-3-carboxylate)
![Methyl 2h-phenanthro[9,10-c]pyrazole-3-carboxylate structure](https://ossimg.kuujia.com/scimg/54500/54415-28-0x500.png)
54415-28-0 structure
Product Name:Methyl 2h-phenanthro[9,10-c]pyrazole-3-carboxylate
CAS No:54415-28-0
MF:C17H12N2O2
MW:276.289383888245
CID:941146
PubChem ID:318637
Update Time:2025-04-19
Methyl 2h-phenanthro[9,10-c]pyrazole-3-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2h-phenanthro[9,10-c]pyrazole-3-carboxylate
- 54415-28-0
- NSC-256394
- DTXSID00312514
- NSC256394
-
- Inchi： 1S/C17H12N2O2/c1-21-17(20)16-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)15(14)18-19-16/h2-9H,1H3,(H,18,19)
- InChI Key： BOSQXGKUYYMYLI-UHFFFAOYSA-N
- SMILES： O(C)C(C1=C2C(C3C=CC=CC=3C3C=CC=CC2=3)=NN1)=O
Computed Properties
- Exact Mass: 276.08996
- Monoisotopic Mass: 276.089877630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 414
- 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?2
Experimental Properties
- PSA: 54.98
Methyl 2h-phenanthro[9,10-c]pyrazole-3-carboxylate Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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4. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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