Cas no 61413-40-9 (Cyclohexanecarboxylic acid, 1-[(3-aminopropyl)amino]-)
![Cyclohexanecarboxylic acid, 1-[(3-aminopropyl)amino]- structure](https://ossimg.kuujia.com/scimg/61500/61413-40-9x500.png)
61413-40-9 structure
Product Name:Cyclohexanecarboxylic acid, 1-[(3-aminopropyl)amino]-
CAS No:61413-40-9
MF:C10H20N2O2
MW:200.278002738953
CID:480445
PubChem ID:20325241
Update Time:2025-04-19
Cyclohexanecarboxylic acid, 1-[(3-aminopropyl)amino]- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarboxylic acid, 1-[(3-aminopropyl)amino]-
- 1-(3-aminopropylamino)cyclohexane-1-carboxylic acid
- 61413-40-9
- 1-[(3-AMINOPROPYL)AMINO]CYCLOHEXANE-1-CARBOXYLIC ACID
- DTXSID80605350
- SCHEMBL11513297
-
- Inchi： 1S/C10H20N2O2/c11-7-4-8-12-10(9(13)14)5-2-1-3-6-10/h12H,1-8,11H2,(H,13,14)
- InChI Key： VBFXJUIZGSZXKC-UHFFFAOYSA-N
- SMILES： OC(C1(CCCCC1)NCCCN)=O
Computed Properties
- Exact Mass: 200.1526
- Monoisotopic Mass: 200.152477885g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 189
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.3
- Topological Polar Surface Area: 75.4?2
Experimental Properties
- PSA: 75.35
Cyclohexanecarboxylic acid, 1-[(3-aminopropyl)amino]- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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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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