Cas no 502161-90-2 (2-Cyclopenten-1-one, 3-[(2-bromophenyl)amino]-)
![2-Cyclopenten-1-one, 3-[(2-bromophenyl)amino]- structure](https://ossimg.kuujia.com/scimg/502500/502161-90-2x500.png)
502161-90-2 structure
Product Name:2-Cyclopenten-1-one, 3-[(2-bromophenyl)amino]-
CAS No:502161-90-2
MF:C11H10BrNO
MW:252.10720205307
CID:1563107
PubChem ID:10879570
Update Time:2025-04-21
2-Cyclopenten-1-one, 3-[(2-bromophenyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- 2-Cyclopenten-1-one, 3-[(2-bromophenyl)amino]-
- 3-(2-bromoanilino)cyclopent-2-en-1-one
- DTXSID70446911
- 502161-90-2
-
- Inchi： 1S/C11H10BrNO/c12-10-3-1-2-4-11(10)13-8-5-6-9(14)7-8/h1-4,7,13H,5-6H2
- InChI Key： JTPFGUQDVWAMQJ-UHFFFAOYSA-N
- SMILES： BrC1C=CC=CC=1NC1=CC(CC1)=O
Computed Properties
- Exact Mass: 250.9946
- Monoisotopic Mass: 250.99458g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 262
- 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: 2.5
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
2-Cyclopenten-1-one, 3-[(2-bromophenyl)amino]- Related Literature
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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