Cas no 306292-64-8 (trans-N1-Ethyl-N4-[2-[4-(ethylamino)butylaminomethyl]cyclopropylmethyl]-1,4-butanediamine tetrahydrochloride)
306292-64-8 structure
Product Name:trans-N1-Ethyl-N4-[2-[4-(ethylamino)butylaminomethyl]cyclopropylmethyl]-1,4-butanediamine tetrahydrochloride
CAS No:306292-64-8
MF:C17H42Cl4N4
MW:444.354180812836
CID:1443863
PubChem ID:10026462
Update Time:2025-04-20
trans-N1-Ethyl-N4-[2-[4-(ethylamino)butylaminomethyl]cyclopropylmethyl]-1,4-butanediamine tetrahydrochloride Chemical and Physical Properties
Names and Identifiers
-
- trans-N1-Ethyl-N4-[2-[4-(ethylamino)butylaminomethyl]cyclopropylmethyl]-1,4-butanediamine tetrahydrochloride
- SL-11093
- trans-1,2-Bis[4-(ethylamino)butylaminomethyl]cyclopropane tetrahydrochloride
- N-ethyl-N'-[[2-[[4-(ethylamino)butylamino]methyl]cyclopropyl]methyl]butane-1,4-diamine,tetrahydrochloride
- UNII-MX8724VFP3
- N~1~,N~1'~-[Cyclopropane-1,2-diylbis(methylene)]bis(N~4~-ethylbutane-1,4-diamine)--hydrogen chloride (1/4)
- DTXSID40952897
- CGC-11093
- 1,2-Cyclopropanedimethanamine, N,N'-bis(4-(ethylamino)butyl)-, tetrahydrochloride, (1R,2S)-rel-
- MX8724VFP3
- 306292-64-8
- 306292-65-9
- CGC 11098
- N-Ethyl-N'-[[2-[[4-(ethylamino)butylamino]methyl]cyclopropyl]methyl]butane-1,4-diamine;tetrahydrochloride
- 3,8,13,18-Tetraaza-10,11-((E)-1,2-cyclopropyl)eicosane tetrahydrochloride
- 1,2-Cyclopropanedimethanamine, N,N'-bis(4-(ethylamino)butyl)-, tetrahydrochloride, (1R,2R)-rel-
- CGC 11093
- CGC-11098
-
- Inchi: 1S/C17H38N4.4ClH/c1-3-18-9-5-7-11-20-14-16-13-17(16)15-21-12-8-6-10-19-4-2;;;;/h16-21H,3-15H2,1-2H3;4*1H
- InChI Key: AXRCRLGWQBZVSB-UHFFFAOYSA-N
- SMILES: Cl.Cl.Cl.Cl.N(CCCCNCC)CC1CC1CNCCCCNCC
Computed Properties
- Exact Mass: 442.21686
- Monoisotopic Mass: 442.216358g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 8
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- Rotatable Bond Count: 16
- Complexity: 201
- Covalently-Bonded Unit Count: 5
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 48.1?2
Experimental Properties
- PSA: 48.12
trans-N1-Ethyl-N4-[2-[4-(ethylamino)butylaminomethyl]cyclopropylmethyl]-1,4-butanediamine tetrahydrochloride Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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