Cas no 5520-31-0 ((4-{[4-(benzyloxy)-3-ethoxybenzyl]oxy}-3-chloro-5-methoxyphenyl)methanol)
![(4-{[4-(benzyloxy)-3-ethoxybenzyl]oxy}-3-chloro-5-methoxyphenyl)methanol structure](https://ossimg.kuujia.com/scimg/6000/5520-31-0x500.png)
5520-31-0 structure
Product Name:(4-{[4-(benzyloxy)-3-ethoxybenzyl]oxy}-3-chloro-5-methoxyphenyl)methanol
CAS No:5520-31-0
MF:C24H25ClO5
MW:428.905306577683
CID:1592942
PubChem ID:5245459
Update Time:2025-04-21
(4-{[4-(benzyloxy)-3-ethoxybenzyl]oxy}-3-chloro-5-methoxyphenyl)methanol Chemical and Physical Properties
Names and Identifiers
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- (4-{[4-(benzyloxy)-3-ethoxybenzyl]oxy}-3-chloro-5-methoxyphenyl)methanol
- [3-chloro-4-[(3-ethoxy-4-phenylmethoxyphenyl)methoxy]-5-methoxyphenyl]methanol
- DTXSID10412897
- 5520-31-0
- AC1NRQKK
-
- Inchi： 1S/C24H25ClO5/c1-3-28-22-12-18(9-10-21(22)29-15-17-7-5-4-6-8-17)16-30-24-20(25)11-19(14-26)13-23(24)27-2/h4-13,26H,3,14-16H2,1-2H3
- InChI Key： IUKKBHFJGFPLRO-UHFFFAOYSA-N
- SMILES： ClC1=CC(CO)=CC(=C1OCC1C=CC(=C(C=1)OCC)OCC1C=CC=CC=1)OC
Computed Properties
- Exact Mass: 428.13915
- Monoisotopic Mass: 428.139052
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 30
- Rotatable Bond Count: 10
- Complexity: 473
- 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
- Topological Polar Surface Area: 57.2
- XLogP3: 4.9
Experimental Properties
- Density: 1.228
- Boiling Point: 574.3°C at 760 mmHg
- Flash Point: 301.1°C
- Refractive Index: 1.59
- PSA: 57.15
(4-{[4-(benzyloxy)-3-ethoxybenzyl]oxy}-3-chloro-5-methoxyphenyl)methanol Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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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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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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