Cas no 57914-22-4 (Phenol, 2,2',2''-[nitrilotris(methylene)]tris[4,6-dimethyl-)
![Phenol, 2,2',2''-[nitrilotris(methylene)]tris[4,6-dimethyl- structure](https://ossimg.kuujia.com/scimg/58000/57914-22-4x500.png)
57914-22-4 structure
Product Name:Phenol, 2,2',2''-[nitrilotris(methylene)]tris[4,6-dimethyl-
CAS No:57914-22-4
MF:C27H33NO3
MW:419.555827856064
CID:343787
PubChem ID:5241994
Update Time:2025-04-19
Phenol, 2,2',2''-[nitrilotris(methylene)]tris[4,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 2,2',2''-[nitrilotris(methylene)]tris[4,6-dimethyl-
- 2-[[bis[(2-hydroxy-3,5-dimethylphenyl)methyl]amino]methyl]-4,6-dimethylphenol
- 57914-22-4
- DTXSID60412625
- SCHEMBL3641661
- tris(2-hydroxy-3,5-dimethylbenzyl)amine
-
- Inchi： 1S/C27H33NO3/c1-16-7-19(4)25(29)22(10-16)13-28(14-23-11-17(2)8-20(5)26(23)30)15-24-12-18(3)9-21(6)27(24)31/h7-12,29-31H,13-15H2,1-6H3
- InChI Key： XYFXPGUEXSGKEL-UHFFFAOYSA-N
- SMILES： OC1C(C)=CC(C)=CC=1CN(CC1C=C(C)C=C(C)C=1O)CC1C=C(C)C=C(C)C=1O
Computed Properties
- Exact Mass: 419.24619
- Monoisotopic Mass: 419.24604391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 31
- Rotatable Bond Count: 6
- Complexity: 481
- 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: 5.9
- Topological Polar Surface Area: 63.9?2
Experimental Properties
- PSA: 63.93
Phenol, 2,2',2''-[nitrilotris(methylene)]tris[4,6-dimethyl- Related Literature
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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