Cas no 71850-75-4 (Phosphonic acid,dieicosyl ester)
71850-75-4 structure
Product Name:Phosphonic acid,dieicosyl ester
CAS No:71850-75-4
MF:C40H82O3P
MW:642.051054477692
CID:567509
PubChem ID:6367253
Update Time:2025-04-19
Phosphonic acid,dieicosyl ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphonic acid,dieicosyl ester
- diicosyl phosphite
- 71850-75-4
- DTXSID90888016
- Phosphonic acid, dieicosyl ester
- Dieicosyl phosphite
- Di(eicosanyl) phosphite
-
- Inchi: 1S/C40H82O3P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-42-44(41)43-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3/q+1
- InChI Key: CIBKDFOCUKQUGT-UHFFFAOYSA-N
- SMILES: [P+](=O)(OCCCCCCCCCCCCCCCCCCCC)OCCCCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 641.60056
- Monoisotopic Mass: 641.60015847g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 44
- Rotatable Bond Count: 40
- Complexity: 483
- 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: 19.8
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
- LogP: 15.76040
Phosphonic acid,dieicosyl ester Related Literature
-
Mei Zhang,Jingjing Guo,Tingting Liu,Zhanyu He,Majeed Irfan,Zujin Zhao,Zhuo Zeng J. Mater. Chem. C, 2020,8, 14919-14924
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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