Cas no 10331-55-2 (Phosphoric acid,bis(4-nitrophenyl) ester, calcium salt (9CI))
10331-55-2 structure
Product Name:Phosphoric acid,bis(4-nitrophenyl) ester, calcium salt (9CI)
CAS No:10331-55-2
MF:C24H16CaN4O16P2
MW:718.426567077637
CID:118536
PubChem ID:19080802
Update Time:2025-04-18
Phosphoric acid,bis(4-nitrophenyl) ester, calcium salt (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Phosphoric acid,bis(4-nitrophenyl) ester, calcium salt (9CI)
- BIS(4-NITROPHENYL)PHOSPHORIC ACID CALCIUM SALT
- Bis[bis(4-nitrophenoxy)phosphinyloxy]calcium
- CALCIUM BIS(4-NITROPHENYL)PHOSPHATE
- DI(4-NITROPHENYL)PHOSPHORIC ACID CALCIUM SALT
- calcium di(p-nitrophenyl) phosphate
- calcium;bis(4-nitrophenyl) phosphate
- 10331-55-2
- SCHEMBL11588707
- Bis(4-nitrophenyl)phosphoricacidcalciumsalt
- calcium bis(4-nitrophenyl) phosphate
- FT-0718174
- bis-(4-Nitrophenyl)phosphoric acid calcium salt
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- Inchi： 1S/2C12H9N2O8P.Ca/c2*15-13(16)9-1-5-11(6-2-9)21-23(19,20)22-12-7-3-10(4-8-12)14(17)18;/h2*1-8H,(H,19,20);/q;;+2/p-2
- InChI Key： DMVNXWRPLOWKPA-UHFFFAOYSA-L
- SMILES： [Ca+2].P(=O)([O-])(OC1C=CC(=CC=1)[N+](=O)[O-])OC1C=CC(=CC=1)[N+](=O)[O-].P(=O)([O-])(OC1C=CC(=CC=1)[N+](=O)[O-])OC1C=CC(=CC=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 717.96600
- Monoisotopic Mass: 717.9662453g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 16
- Heavy Atom Count: 47
- Rotatable Bond Count: 8
- Complexity: 426
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 301?2
Experimental Properties
- PSA: 320.08000
- LogP: 9.09160
Phosphoric acid,bis(4-nitrophenyl) ester, calcium salt (9CI) Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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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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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
10331-55-2 (Phosphoric acid,bis(4-nitrophenyl) ester, calcium salt (9CI)) Related Products
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