Cas no 75677-04-2 (Benzenepropanal, 3-(phenylmethoxy)-)
75677-04-2 structure
Product Name:Benzenepropanal, 3-(phenylmethoxy)-
CAS No:75677-04-2
MF:C16H16O2
MW:240.297044754028
CID:832754
PubChem ID:14486778
Update Time:2025-04-19
Benzenepropanal, 3-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanal, 3-(phenylmethoxy)-
- 3-(PHENYLMETHOXY)-BENZENEPROPANAL
- 3-[3-(Benzyloxy)phenyl]propanal
- LogP
- 75677-04-2
- Benzenepropanal,3-(phenylmethoxy)-
- 3-(3-(Benzyloxy)phenyl)propanal
- SCHEMBL18383719
-
- Inchi： 1S/C16H16O2/c17-11-5-9-14-8-4-10-16(12-14)18-13-15-6-2-1-3-7-15/h1-4,6-8,10-12H,5,9,13H2
- InChI Key： IPHLHNBJXAFUIE-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1=CC=CC(=C1)CCC=O
Computed Properties
- Exact Mass: 240.115029749g/mol
- Monoisotopic Mass: 240.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 233
- 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: 3.1
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 1.088
- Boiling Point: 373.8°C at 760 mmHg
- Flash Point: 163.1°C
- Refractive Index: 1.563
Benzenepropanal, 3-(phenylmethoxy)- Related Literature
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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