Cas no 6322-52-7 (2-amino-2-methyldodec-11-enoic acid)
6322-52-7 structure
Product Name:2-amino-2-methyldodec-11-enoic acid
CAS No:6322-52-7
MF:C13H25NO2
MW:227.343104124069
CID:959304
PubChem ID:233531
Update Time:2025-04-19
2-amino-2-methyldodec-11-enoic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-amino-2-methyldodec-11-enoic acid
- NSC32108
- DTXSID80283556
- 6322-52-7
- NSC-32108
-
- Inchi： 1S/C13H25NO2/c1-3-4-5-6-7-8-9-10-11-13(2,14)12(15)16/h3H,1,4-11,14H2,2H3,(H,15,16)
- InChI Key： NIZDOMFZGSADGL-UHFFFAOYSA-N
- SMILES： OC(C(C)(CCCCCCCCC=C)N)=O
Computed Properties
- Exact Mass: 227.18865
- Monoisotopic Mass: 227.189
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 10
- Complexity: 216
- 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: 1.4
- Topological Polar Surface Area: 63.3?2
Experimental Properties
- Density: 0.96g/cm3
- Boiling Point: 339.8oC at 760 mmHg
- Flash Point: 159.3oC
- Refractive Index: 1.478
- PSA: 63.32
- LogP: 3.79550
2-amino-2-methyldodec-11-enoic acid Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
6322-52-7 (2-amino-2-methyldodec-11-enoic acid) Related Products
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