Cas no 827024-00-0 (1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)-)
![1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)- structure](https://ossimg.kuujia.com/scimg/827500/827024-00-0x500.png)
827024-00-0 structure
Product Name:1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)-
CAS No:827024-00-0
MF:C16H19NO3S
MW:305.391963243485
CID:686526
PubChem ID:71417845
Update Time:2025-04-19
1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)-
- 1-[1-(4-methylphenyl)sulfonylpyrrol-2-yl]pentan-1-one
- 1-[1-(4-Methylbenzene-1-sulfonyl)-1H-pyrrol-2-yl]pentan-1-one
- DTXSID40837175
- 827024-00-0
-
- Inchi： 1S/C16H19NO3S/c1-3-4-7-16(18)15-6-5-12-17(15)21(19,20)14-10-8-13(2)9-11-14/h5-6,8-12H,3-4,7H2,1-2H3
- InChI Key： OTWKSXIUQNZQQS-UHFFFAOYSA-N
- SMILES： S(C1C=CC(C)=CC=1)(N1C=CC=C1C(CCCC)=O)(=O)=O
Computed Properties
- Exact Mass: 305.10856464g/mol
- Monoisotopic Mass: 305.10856464g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 6
- Complexity: 447
- 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: 3.6
- Topological Polar Surface Area: 64.5?2
1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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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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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
827024-00-0 (1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-2-(1-oxopentyl)-) Related Products
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