Cas no 77737-07-6 (2,4-Imidazolidinedione,5-phenyl-5-(phenyl-4-d)-, monosodium salt (9CI))
77737-07-6 structure
Product Name:2,4-Imidazolidinedione,5-phenyl-5-(phenyl-4-d)-, monosodium salt (9CI)
CAS No:77737-07-6
MF:C15H11N2NaO2
MW:275.255975961685
CID:576901
PubChem ID:23688099
Update Time:2025-04-19
2,4-Imidazolidinedione,5-phenyl-5-(phenyl-4-d)-, monosodium salt (9CI) Chemical and Physical Properties
Names and Identifiers
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- 2,4-Imidazolidinedione,5-phenyl-5-(phenyl-4-d)-, monosodium salt (9CI)
- sodium,5-(4-deuteriophenyl)-5-phenylimidazolidin-3-ide-2,4-dione
- Phenytoin sodium, 4-deutero-
- 77737-07-6
- 2,4-Imidazolidinedione, 5-phenyl-5-(phenyl-4-d)-, monosodium salt
-
- Inchi： 1S/C15H12N2O2.Na/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12;/h1-10H,(H2,16,17,18,19);/q;+1/p-1/i1D;
- InChI Key： FJPYVLNWWICYDW-RWQOXAPSSA-M
- SMILES： [Na+].O=C1C(C2C=CC=CC=2)(C2C=CC([2H])=CC=2)NC([N-]1)=O
Computed Properties
- Exact Mass: 275.078099
- Monoisotopic Mass: 275.078099
- Isotope Atom Count: 1
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 376
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 47.2
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
2,4-Imidazolidinedione,5-phenyl-5-(phenyl-4-d)-, monosodium salt (9CI) Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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