Cas no 77116-68-8 (1,4-Benzenediamine, N,N-dimethyl-N'-(triphenylphosphoranylidene)-)
77116-68-8 structure
Product Name:1,4-Benzenediamine, N,N-dimethyl-N'-(triphenylphosphoranylidene)-
CAS No:77116-68-8
MF:C26H25N2P
MW:396.463866949081
CID:536754
PubChem ID:13145337
Update Time:2025-04-19
1,4-Benzenediamine, N,N-dimethyl-N'-(triphenylphosphoranylidene)- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Benzenediamine, N,N-dimethyl-N'-(triphenylphosphoranylidene)-
- N,N-dimethyl-4-[(triphenyl-λ<sup>5</sup>-phosphanylidene)amino]aniline
- DTXSID80521849
- N,N-Dimethyl-4-[(triphenyl-lambda~5~-phosphanylidene)amino]aniline
- 77116-68-8
- C26H25N2P
-
- Inchi： 1S/C26H25N2P/c1-28(2)23-20-18-22(19-21-23)27-29(24-12-6-3-7-13-24,25-14-8-4-9-15-25)26-16-10-5-11-17-26/h3-21H,1-2H3
- InChI Key： CDKCYOMDFNXOIF-UHFFFAOYSA-N
- SMILES： P(C1C=CC=CC=1)(C1C=CC=CC=1)(C1C=CC=CC=1)=NC1C=CC(=CC=1)N(C)C
Computed Properties
- Exact Mass: 396.17575
- Monoisotopic Mass: 396.175535804g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 29
- Rotatable Bond Count: 5
- Complexity: 479
- 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: 6.6
- Topological Polar Surface Area: 15.6?2
Experimental Properties
- PSA: 15.6
1,4-Benzenediamine, N,N-dimethyl-N'-(triphenylphosphoranylidene)- Related Literature
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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