Cas no 88341-04-2 (Isoquinolinium, 1,2,3,4-tetrahydro-2-methyl-2-propyl-, iodide)
88341-04-2 structure
Product Name:Isoquinolinium, 1,2,3,4-tetrahydro-2-methyl-2-propyl-, iodide
CAS No:88341-04-2
MF:C13H20IN
MW:317.209075927734
CID:636507
PubChem ID:71408968
Update Time:2025-04-19
Isoquinolinium, 1,2,3,4-tetrahydro-2-methyl-2-propyl-, iodide Chemical and Physical Properties
Names and Identifiers
-
- Isoquinolinium, 1,2,3,4-tetrahydro-2-methyl-2-propyl-, iodide
- 2-methyl-2-propyl-3,4-dihydro-1H-isoquinolin-2-ium,iodide
- DTXSID60828742
- 88341-04-2
- 2-Methyl-2-propyl-1,2,3,4-tetrahydroisoquinolin-2-ium iodide
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- Inchi： 1S/C13H20N.HI/c1-3-9-14(2)10-8-12-6-4-5-7-13(12)11-14;/h4-7H,3,8-11H2,1-2H3;1H/q+1;/p-1
- InChI Key： VAFYCTMDJXOALQ-UHFFFAOYSA-M
- SMILES： [I-].[N+]1(C)(CCC)CC2C=CC=CC=2CC1
Computed Properties
- Exact Mass: 317.06405g/mol
- Monoisotopic Mass: 317.06405g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 190
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 0?2
Isoquinolinium, 1,2,3,4-tetrahydro-2-methyl-2-propyl-, iodide Related Literature
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
88341-04-2 (Isoquinolinium, 1,2,3,4-tetrahydro-2-methyl-2-propyl-, iodide) Related Products
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