Cas no 1420810-59-8 (4-N-(4-Chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine;hydrochloride)
1420810-59-8 structure
Product Name:4-N-(4-Chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine;hydrochloride
CAS No:1420810-59-8
MF:C11H18Cl2N4
MW:277.193419933319
CID:2164363
Update Time:2023-08-05
4-N-(4-Chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine;hydrochloride Chemical and Physical Properties
Names and Identifiers
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- (1R,4r)-n1-(4-chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine hydrochloride
- N1-(4-chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine hydrochloride
- 4-N-(4-Chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine;hydrochloride
-
- Inchi： 1S/C11H17ClN4.ClH/c1-7-6-14-11(16-10(7)12)15-9-4-2-8(13)3-5-9;/h6,8-9H,2-5,13H2,1H3,(H,14,15,16);1H
- InChI Key： OYVKPOWQECWJPW-UHFFFAOYSA-N
- SMILES： ClC1=C(C)C=NC(=N1)NC1CCC(CC1)N.Cl
Computed Properties
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 218
- Topological Polar Surface Area: 63.8
4-N-(4-Chloro-5-methylpyrimidin-2-yl)cyclohexane-1,4-diamine;hydrochloride Related Literature
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2. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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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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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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