Cas no 1241-26-5 (1,4-Cyclohexanebis(methylamine),N,N'-bis[(tetrahydro-2H-pyran-2-yl)methyl]-, dihydrochloride, trans- (8CI))
1241-26-5 structure
Product Name:1,4-Cyclohexanebis(methylamine),N,N'-bis[(tetrahydro-2H-pyran-2-yl)methyl]-, dihydrochloride, trans- (8CI)
CAS No:1241-26-5
MF:C20H40Cl2N2O2
MW:411.44980430603
CID:165822
PubChem ID:102584
Update Time:2025-04-19
1,4-Cyclohexanebis(methylamine),N,N'-bis[(tetrahydro-2H-pyran-2-yl)methyl]-, dihydrochloride, trans- (8CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Cyclohexanebis(methylamine),N,N'-bis[(tetrahydro-2H-pyran-2-yl)methyl]-, dihydrochloride, trans- (8CI)
- N-(oxan-2-ylmethyl)-1-[4-[(oxan-2-ylmethylamino)methyl]cyclohexyl]methanamine,dihydrochloride
- trans-N,N'-Bis((tetrahydro-2H-pyran-2-yl)methyl)-1,4-cyclohexane bis(methylamine)
- 1,4-Cyclohexanebis(methylamine), N,N'-bis(3,4,5,6-tetrahydropyran-2-ylmethyl)-, dihydrochloride, (E)-
- DTXSID40924731
- N,N'-[Cyclohexane-1,4-diylbis(methylene)]bis[1-(oxan-2-yl)methanamine]--hydrogen chloride (1/2)
- 1241-26-5
-
- Inchi: 1S/C20H38N2O2.2ClH/c1-3-11-23-19(5-1)15-21-13-17-7-9-18(10-8-17)14-22-16-20-6-2-4-12-24-20;;/h17-22H,1-16H2;2*1H
- InChI Key: PVIYWTLLWCNTQD-UHFFFAOYSA-N
- SMILES: Cl.Cl.O1CCCCC1CNCC1CCC(CNCC2CCCCO2)CC1
Computed Properties
- Exact Mass: 410.247
- Monoisotopic Mass: 410.247
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 26
- Rotatable Bond Count: 8
- Complexity: 300
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 42.5?2
Experimental Properties
- Boiling Point: 464.6°Cat760mmHg
- Flash Point: 204.1°C
- PSA: 42.52
1,4-Cyclohexanebis(methylamine),N,N'-bis[(tetrahydro-2H-pyran-2-yl)methyl]-, dihydrochloride, trans- (8CI) Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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