Cas no 10542-44-6 (2-Propyn-1-amine,N-propyl-N-2-propyn-1-yl-)
10542-44-6 structure
Product Name:2-Propyn-1-amine,N-propyl-N-2-propyn-1-yl-
2-Propyn-1-amine,N-propyl-N-2-propyn-1-yl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propyn-1-amine,N-propyl-N-2-propyn-1-yl-
- N,N-bis(prop-2-ynyl)propan-1-amine
- AC1L3EFT
- N.N-Bis-(prop-2-inyl)-propylamin
- N.N-Bis-< prop-2-inyl> -propylamin
- N-n-Propyldi-2-propinylamin
- N-propyldipropargylamine
- N-propyl-N,N-dipropargylamine
- Propyldi-2-proynylamine
- DTXSID80147124
- 10542-44-6
-
- Inchi： 1S/C9H13N/c1-4-7-10(8-5-2)9-6-3/h1-2H,6-9H2,3H3
- InChI Key： JEBZDOHTAAPMHD-UHFFFAOYSA-N
- SMILES： N(CC#C)(CC#C)CCC
Computed Properties
- Exact Mass: 135.10489
- Monoisotopic Mass: 135.105
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 146
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 3.2?2
Experimental Properties
- Density: 0.89
- Boiling Point: 184.2°Cat760mmHg
- Flash Point: 57.7°C
- Refractive Index: 1.479
- PSA: 3.24
- LogP: 0.96480
2-Propyn-1-amine,N-propyl-N-2-propyn-1-yl- Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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