Cas no 1004316-77-1 ((2S,5S)-1,6-Diphenyl-2,5-hexanediamine)
1004316-77-1 structure
Product Name:(2S,5S)-1,6-Diphenyl-2,5-hexanediamine
CAS No:1004316-77-1
MF:C18H24N2
MW:268.396564483643
CID:4558712
Update Time:2023-08-09
(2S,5S)-1,6-Diphenyl-2,5-hexanediamine Chemical and Physical Properties
Names and Identifiers
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- (2S,5S)-1,6-Diphenyl-2,5-hexanediamine
-
- Inchi： 1S/C18H24N2/c19-17(13-15-7-3-1-4-8-15)11-12-18(20)14-16-9-5-2-6-10-16/h1-10,17-18H,11-14,19-20H2/t17-,18-/m0/s1
- InChI Key： CTVQBUFULGSGGL-ROUUACIJSA-N
- SMILES： N[C@H](CC1C=CC=CC=1)CC[C@@H](CC1C=CC=CC=1)N
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 216
- XLogP3: 3.2
- Topological Polar Surface Area: 52
Experimental Properties
- Density: 1.044±0.06 g/cm3 (20 oC 760 Torr),
- Solubility: Very slightly soluble (0.21 g/l) (25 o C),
(2S,5S)-1,6-Diphenyl-2,5-hexanediamine Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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