Cas no 80252-38-6 (Hexadecanoic acid, dotriacontyl ester)
80252-38-6 structure
Product Name:Hexadecanoic acid, dotriacontyl ester
CAS No:80252-38-6
MF:C48H96O2
MW:705.274656295776
CID:706005
PubChem ID:13908813
Update Time:2025-04-19
Hexadecanoic acid, dotriacontyl ester Chemical and Physical Properties
Names and Identifiers
-
- Hexadecanoic acid, dotriacontyl ester
- dotriacontyl hexadecanoate
- 80252-38-6
- Laccerylpalmitat
- DTXSID20552339
-
- Inchi： 1S/C48H96O2/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-41-43-45-47-50-48(49)46-44-42-40-38-36-34-16-14-12-10-8-6-4-2/h3-47H2,1-2H3
- InChI Key： FMGHDGZLCHHZKR-UHFFFAOYSA-N
- SMILES： O(C(CCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 704.74103230g/mol
- Monoisotopic Mass: 704.74103230g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 50
- Rotatable Bond Count: 46
- Complexity: 601
- 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: 23.9
- Topological Polar Surface Area: 26.3?2
Hexadecanoic acid, dotriacontyl ester Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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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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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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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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