Cas no 107019-94-3 (2,6-Piperidinediethanol,a,a'-dipropyl-, (aR,a'S,2S,6R)-rel- (9CI))
107019-94-3 structure
Product Name:2,6-Piperidinediethanol,a,a'-dipropyl-, (aR,a'S,2S,6R)-rel- (9CI)
CAS No:107019-94-3
MF:C15H31NO2
MW:257.412144899368
CID:189253
Update Time:2024-03-01
2,6-Piperidinediethanol,a,a'-dipropyl-, (aR,a'S,2S,6R)-rel- (9CI) Chemical and Physical Properties
Names and Identifiers
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- 2,6-Piperidinediethanol,a,a'-dipropyl-, (aR,a'S,2S,6R)-rel- (9CI)
- 2,6-Piperidinediethanol,a,a'-dipropyl-, [2a(S*),6a(R*)]-
- Andrachamine
- 2,6-Piperidinediethanol, α,α'-dipropyl-, (αR,α'S,2S,6R)-rel- (9CI)
-
- Inchi： 1S/C15H31NO2/c1-3-6-14(17)10-12-8-5-9-13(16-12)11-15(18)7-4-2/h12-18H,3-11H2,1-2H3
- InChI Key： YASYAQIAFYRYBX-UHFFFAOYSA-N
- SMILES： CCCC(CC1NC(CC(CCC)O)CCC1)O
Computed Properties
- Exact Mass: 272.08309
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- XLogP3: 3.692
Experimental Properties
- Density: 0.944±0.06 g/cm3(Predicted)
- Boiling Point: 401.2±20.0 °C(Predicted)
- PSA: 52.54
- pka: 14.92±0.20(Predicted)
2,6-Piperidinediethanol,a,a'-dipropyl-, (aR,a'S,2S,6R)-rel- (9CI) Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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