Cas no 38876-40-3 (Cyclohexanecarboxylic acid, 4-(aminomethyl)-3-methyl-)
38876-40-3 structure
Product Name:Cyclohexanecarboxylic acid, 4-(aminomethyl)-3-methyl-
CAS No:38876-40-3
MF:C9H17NO2
MW:171.23678278923
CID:1493236
Update Time:2024-08-24
Cyclohexanecarboxylic acid, 4-(aminomethyl)-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboxylic acid, 4-(aminomethyl)-3-methyl-
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- Inchi： 1S/C9H17NO2/c1-6-4-7(9(11)12)2-3-8(6)5-10/h6-8H,2-5,10H2,1H3,(H,11,12)
- InChI Key： NUPAQYUDSOHPKP-UHFFFAOYSA-N
- SMILES： C1(C(O)=O)CCC(CN)C(C)C1
Computed Properties
- Exact Mass: 171.12601
Experimental Properties
- Density: 1.047±0.06 g/cm3(Predicted)
- Boiling Point: 304.3±15.0 °C(Predicted)
- PSA: 63.32
- pka: 4.74±0.16(Predicted)
Cyclohexanecarboxylic acid, 4-(aminomethyl)-3-methyl- Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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