Cas no 53580-91-9 (Pyridine, 2-methyl-3-(phenylmethoxy)-4,5-bis[(phenylmethoxy)methyl]-)
53580-91-9 structure
Product Name:Pyridine, 2-methyl-3-(phenylmethoxy)-4,5-bis[(phenylmethoxy)methyl]-
CAS No:53580-91-9
MF:C29H29NO3
MW:439.545468091965
CID:356937
PubChem ID:21854032
Update Time:2025-04-19
Pyridine, 2-methyl-3-(phenylmethoxy)-4,5-bis[(phenylmethoxy)methyl]- Chemical and Physical Properties
Names and Identifiers
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- Pyridine, 2-methyl-3-(phenylmethoxy)-4,5-bis[(phenylmethoxy)methyl]-
- 2-methyl-3-phenylmethoxy-4,5-bis(phenylmethoxymethyl)pyridine
- DTXSID40618825
- 53580-91-9
- 3-(Benzyloxy)-4,5-bis[(benzyloxy)methyl]-2-methylpyridine
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- Inchi: 1S/C29H29NO3/c1-23-29(33-20-26-15-9-4-10-16-26)28(22-32-19-25-13-7-3-8-14-25)27(17-30-23)21-31-18-24-11-5-2-6-12-24/h2-17H,18-22H2,1H3
- InChI Key: JEKFZCHTFLHPEJ-UHFFFAOYSA-N
- SMILES: O(CC1C=CC=CC=1)C1C(C)=NC=C(COCC2C=CC=CC=2)C=1COCC1C=CC=CC=1
Computed Properties
- Exact Mass: 439.21487
- Monoisotopic Mass: 439.21474379g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 33
- Rotatable Bond Count: 11
- Complexity: 511
- 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
- Topological Polar Surface Area: 40.6?2
Experimental Properties
- PSA: 40.58
Pyridine, 2-methyl-3-(phenylmethoxy)-4,5-bis[(phenylmethoxy)methyl]- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Danlei Xiang Nanoscale, 2021,13, 5497-5506
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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