Cas no 75949-74-5 ((2S,2'R)-N~1~,N~2~'-ethane-1,2-diyldipropane-1,2-diamine)
75949-74-5 structure
Product Name:(2S,2'R)-N~1~,N~2~'-ethane-1,2-diyldipropane-1,2-diamine
CAS No:75949-74-5
MF:C8H22N4
MW:174.287081241608
CID:1780006
PubChem ID:20834301
Update Time:2025-04-21
(2S,2'R)-N~1~,N~2~'-ethane-1,2-diyldipropane-1,2-diamine Chemical and Physical Properties
Names and Identifiers
-
- (2S,2'R)-N~1~,N~2~'-ethane-1,2-diyldipropane-1,2-diamine
- (2R)-2-N-[2-[[(2S)-2-aminopropyl]amino]ethyl]propane-1,2-diamine
- SCHEMBL22662819
- UDRMRSLPPDGMPF-UHFFFAOYSA-N
- 75949-74-5
- DTXSID00888507
- 1,2-Propanediamine, N1-[2-[(2-amino-1-methylethyl)amino]ethyl]-
-
- Inchi： 1S/C8H22N4/c1-7(10)6-11-3-4-12-8(2)5-9/h7-8,11-12H,3-6,9-10H2,1-2H3
- InChI Key： UDRMRSLPPDGMPF-UHFFFAOYSA-N
- SMILES： N(CCNCC(C)N)C(C)CN
Computed Properties
- Exact Mass: 174.18466
- Monoisotopic Mass: 174.18444672g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 7
- Complexity: 97.1
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.6
- Topological Polar Surface Area: 76.1?2
Experimental Properties
- PSA: 76.1
(2S,2'R)-N~1~,N~2~'-ethane-1,2-diyldipropane-1,2-diamine Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Wenjie Zhao,Hua Hou,Yuchun Jin,Zhixiang Zeng,Xuedong Wu,Qunji Xue RSC Adv., 2014,4, 60307-60315
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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