Cas no 220270-63-3 (Ethanone,2-bromo-1-(1-methyl-1H-pyrrol-3-yl)-)
220270-63-3 structure
Product Name:Ethanone,2-bromo-1-(1-methyl-1H-pyrrol-3-yl)-
CAS No:220270-63-3
MF:C7H8BrNO
MW:202.04852104187
CID:243880
PubChem ID:18367841
Update Time:2025-04-19
Ethanone,2-bromo-1-(1-methyl-1H-pyrrol-3-yl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,2-bromo-1-(1-methyl-1H-pyrrol-3-yl)-
- 3-(Bromoacetyl)-1-methylpyrrole
- 2-bromo-1-(1-methylpyrrol-3-yl)ethanone
- 2-Bromo-1-(1-methyl-1H-pyrrol-3-yl)ethan-1-one
- DTXSID10593170
- 220270-63-3
- SCHEMBL7502013
- 2-Bromo-1-(1-methyl-1H-pyrrol-3-yl)ethanone
-
- Inchi： 1S/C7H8BrNO/c1-9-3-2-6(5-9)7(10)4-8/h2-3,5H,4H2,1H3
- InChI Key： YRELCDYVYXDYBH-UHFFFAOYSA-N
- SMILES： BrCC(C1C=CN(C)C=1)=O
Computed Properties
- Exact Mass: 200.97894
- Monoisotopic Mass: 200.97893g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 138
- 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: 1.1
- Topological Polar Surface Area: 22?2
Experimental Properties
- PSA: 22
Ethanone,2-bromo-1-(1-methyl-1H-pyrrol-3-yl)- Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Ying Li,Weirong Yao,Yunfei Xie,Renjun Pei RSC Adv., 2015,5, 98724-98729
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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