Cas no 205433-75-6 (Benzeneacetaldehyde, 5-methoxy-2-(phenylmethoxy)-)
205433-75-6 structure
Product Name:Benzeneacetaldehyde, 5-methoxy-2-(phenylmethoxy)-
CAS No:205433-75-6
MF:C16H16O3
MW:256.296444892883
CID:1394288
PubChem ID:11032493
Update Time:2025-04-20
Benzeneacetaldehyde, 5-methoxy-2-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneacetaldehyde, 5-methoxy-2-(phenylmethoxy)-
- 2-(5-methoxy-2-phenylmethoxyphenyl)acetaldehyde
- 205433-75-6
- DTXSID10452692
-
- Inchi： 1S/C16H16O3/c1-18-15-7-8-16(14(11-15)9-10-17)19-12-13-5-3-2-4-6-13/h2-8,10-11H,9,12H2,1H3
- InChI Key： NARNFEYPHPLUEA-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1C=CC(=CC=1CC=O)OC
Computed Properties
- Exact Mass: 256.10998
- Monoisotopic Mass: 256.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 261
- 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: 2.8
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Benzeneacetaldehyde, 5-methoxy-2-(phenylmethoxy)- Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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