Cas no 860351-60-6 ((1S,3S)-Cyclohexane-1,3-diamine;hydrochloride)
860351-60-6 structure
Product Name:(1S,3S)-Cyclohexane-1,3-diamine;hydrochloride
CAS No:860351-60-6
MF:C6H15ClN2
MW:150.649700403214
CID:2158002
Update Time:2023-08-05
(1S,3S)-Cyclohexane-1,3-diamine;hydrochloride Chemical and Physical Properties
Names and Identifiers
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- Trans-cyclohexane-1,3-diamine hydrochloride
- Trans-cyclohexane-1,3-diamine
- (1S,3S)-Cyclohexane-1,3-diamine;hydrochloride
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- Inchi： 1S/C6H14N2.ClH/c7-5-2-1-3-6(8)4-5;/h5-6H,1-4,7-8H2;1H/t5-,6-;/m0./s1
- InChI Key： MVUYVVKSXCLYSP-GEMLJDPKSA-N
- SMILES： Cl.N[C@H]1CCC[C@@H](C1)N
Computed Properties
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 64.9
- Topological Polar Surface Area: 52
(1S,3S)-Cyclohexane-1,3-diamine;hydrochloride Related Literature
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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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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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