Cas no 14512-84-6 (Phenol,3,5-dinitro-, dihydrogen phosphate (ester) (8CI,9CI))
14512-84-6 structure
Product Name:Phenol,3,5-dinitro-, dihydrogen phosphate (ester) (8CI,9CI)
CAS No:14512-84-6
MF:C6H5N2O8P
MW:264.086262464523
CID:234556
PubChem ID:151920
Update Time:2025-04-19
Phenol,3,5-dinitro-, dihydrogen phosphate (ester) (8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- Phenol,3,5-dinitro-, dihydrogen phosphate (ester) (8CI,9CI)
- 3,5-dinitrophenyl phosphate
- 3,5-dinitrophenyl dihydrogen phosphate
- Phenol, 3,5-dinitro-, dihydrogen phosphate (ester)
- DTXSID00932498
- 14512-84-6
- (3,5-dinitrophenyl) dihydrogen phosphate
- 3,5-Dinitrophenylphosphate
-
- Inchi: 1S/C6H5N2O8P/c9-7(10)4-1-5(8(11)12)3-6(2-4)16-17(13,14)15/h1-3H,(H2,13,14,15)
- InChI Key: FINQJAOKEWHFOX-UHFFFAOYSA-N
- SMILES: P(=O)(O)(O)OC1C=C(C=C(C=1)[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 263.97835
- Monoisotopic Mass: 263.97835212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 334
- 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: -0.1
- Topological Polar Surface Area: 158?2
Experimental Properties
- PSA: 153.04
Phenol,3,5-dinitro-, dihydrogen phosphate (ester) (8CI,9CI) Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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3. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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