Cas no 5428-06-8 (Cyclohexanepropanoicacid, a-(methylamino)-)
5428-06-8 structure
Product Name:Cyclohexanepropanoicacid, a-(methylamino)-
CAS No:5428-06-8
MF:C10H19NO2
MW:185.26336312294
CID:382375
PubChem ID:224398
Update Time:2025-04-19
Cyclohexanepropanoicacid, a-(methylamino)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanepropanoicacid, a-(methylamino)-
- NSC-12798
- (S)-a-(Methylamino)cyclohexanepropanoic acid
- 3-cyclohexyl-2-(methylamino)propanoic acid
- (R)-a-(Methylamino)cyclohexanepropanoic acid
- 5428-06-8
- SCHEMBL7571759
- a-(Methylamino)cyclohexanepropanoic acid
- NSC12798
- 862504-03-8
- AKOS017531229
- 56564-53-5
- 2165389-05-7
-
- Inchi： 1S/C10H19NO2/c1-11-9(10(12)13)7-8-5-3-2-4-6-8/h8-9,11H,2-7H2,1H3,(H,12,13)
- InChI Key： GBMDYACPQYNUGA-UHFFFAOYSA-N
- SMILES： OC(C(CC1CCCCC1)NC)=O
Computed Properties
- Exact Mass: 185.14167
- Monoisotopic Mass: 185.142
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 164
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.2
- Topological Polar Surface Area: 49.3?2
Experimental Properties
- Density: 1.024
- Boiling Point: 305.2°Cat760mmHg
- Flash Point: 138.4°C
- Refractive Index: 1.48
- PSA: 49.33
- LogP: 2.02030
Cyclohexanepropanoicacid, a-(methylamino)- Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Tanya Ostapenko,Peter J. Collings,Samuel N. Sprunt,J. T. Gleeson Soft Matter, 2013,9, 9487-9498
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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