Cas no 7500-00-7 (4,7-Methano-1H-isoindolium,2,3,3a,4,7,7a-hexahydro-2,2-dimethyl-, iodide (1:1))
7500-00-7 structure
Product Name:4,7-Methano-1H-isoindolium,2,3,3a,4,7,7a-hexahydro-2,2-dimethyl-, iodide (1:1)
4,7-Methano-1H-isoindolium,2,3,3a,4,7,7a-hexahydro-2,2-dimethyl-, iodide (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 4,7-Methano-1H-isoindolium,2,3,3a,4,7,7a-hexahydro-2,2-dimethyl-, iodide (1:1)
- 2,2-dimethyl-(3ac,7ac)-1,3,3a,4,7,7a-hexahydro-4r,7c-methano-isoindolium, iodide
- 2,2-Dimethyl-(3ac,7ac)-1,3,3a,4,7,7a-hexahydro-4r,7c-methano-isoindolium, Jodid
- 4,7-Methano-1H-isoindolium, 2,3,3a,4,7,7a-hexahydro-2,2-dimethyl-
- AC1L90XW
- NSC400080
- 7500-00-7
- NSC 400080
- SCHEMBL12393355
-
- Inchi： 1S/C11H18N/c1-12(2)6-10-8-3-4-9(5-8)11(10)7-12/h3-4,8-11H,5-7H2,1-2H3/q+1
- InChI Key： QDAIJGUPJLWODC-UHFFFAOYSA-N
- SMILES： [N+]1(C)(C)CC2C3C=CC(C3)C2C1
Computed Properties
- Exact Mass: 164.14404
- Monoisotopic Mass: 164.143924578g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 219
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 4
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
- LogP: -1.52250
4,7-Methano-1H-isoindolium,2,3,3a,4,7,7a-hexahydro-2,2-dimethyl-, iodide (1:1) Related Literature
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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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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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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