Cas no 22217-77-2 (2H-Pyrrole, 3,4-dihydro-5-(4-methylphenyl)-)
22217-77-2 structure
Product Name:2H-Pyrrole, 3,4-dihydro-5-(4-methylphenyl)-
CAS No:22217-77-2
MF:C11H13N
MW:159.227622747421
CID:1408161
PubChem ID:12327449
Update Time:2025-04-20
2H-Pyrrole, 3,4-dihydro-5-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyrrole, 3,4-dihydro-5-(4-methylphenyl)-
- NoName_3164
- 5-(p-Tolyl)-3,4-dihydro-2H-pyrrole
- SY253294
- AKOS025213953
- MFCD28040028
- DTXSID90902625
- 22217-77-2
-
- Inchi: 1S/C11H13N/c1-9-4-6-10(7-5-9)11-3-2-8-12-11/h4-7H,2-3,8H2,1H3
- InChI Key: XQWIWECDDSGMPG-UHFFFAOYSA-N
- SMILES: N1CCCC=1C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 159.10489
- Monoisotopic Mass: 159.104799419g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 175
- 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
- Topological Polar Surface Area: 12.4?2
Experimental Properties
- PSA: 12.36
2H-Pyrrole, 3,4-dihydro-5-(4-methylphenyl)- Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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