Cas no 3900-13-8 (Phosphoric acid,dihexyl ester)
Phosphoric acid,dihexyl ester structure
Product Name:Phosphoric acid,dihexyl ester
CAS No:3900-13-8
MF:C12H27O4P
MW:266.314145326614
CID:308956
PubChem ID:77505
Update Time:2025-04-19
Phosphoric acid,dihexyl ester Chemical and Physical Properties
Names and Identifiers
-
- Phosphoric acid,dihexyl ester
- Dihexyl hydrogen phosphate
- phosphoric acid dihexyl ester
- Q27268794
- UNII-7SOZ72T750
- dihexyl phosphate
- 7SOZ72T750
- EINECS 223-452-2
- DTXSID40192276
- HEXYL PHOSPHATE ((C6H13O)2(HO)PO)
- NS00046286
- SCHEMBL187773
- Phosphoric acid, dihexyl ester
- 3900-13-8
-
- Inchi： 1S/C12H27O4P/c1-3-5-7-9-11-15-17(13,14)16-12-10-8-6-4-2/h3-12H2,1-2H3,(H,13,14)
- InChI Key： HUDSKKNIXMSHSZ-UHFFFAOYSA-N
- SMILES： P(=O)(O)(OCCCCCC)OCCCCCC
Computed Properties
- Exact Mass: 266.16481
- Monoisotopic Mass: 266.16469634g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 12
- Complexity: 191
- 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: 3.7
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76
Phosphoric acid,dihexyl ester Related Literature
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
3900-13-8 (Phosphoric acid,dihexyl ester) Related Products
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- 1806-54-8(Phosphoric acid,trioctyl ester)
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- 19035-79-1(Potassium Hexadecyl Hydrogenphosphate (~90%))
- 2528-39-4(Trihexyl Phosphate (>90%))
- 2627-35-2(dodecyl dihydrogen phosphate)
- 126-73-8(Tributyl phosphate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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