Cas no 52249-82-8 (Benzaldehyde, 2,3,6-trimethoxy-4-(phenylmethoxy)-)
52249-82-8 structure
Product Name:Benzaldehyde, 2,3,6-trimethoxy-4-(phenylmethoxy)-
CAS No:52249-82-8
MF:C17H18O5
MW:302.321825504303
CID:360100
PubChem ID:57327463
Update Time:2025-04-19
Benzaldehyde, 2,3,6-trimethoxy-4-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 2,3,6-trimethoxy-4-(phenylmethoxy)-
- 2,3,6-trimethoxy-4-phenylmethoxybenzaldehyde
- DTXSID60720838
- 52249-82-8
- 4-(Benzyloxy)-2,3,6-trimethoxybenzaldehyde
-
- Inchi: 1S/C17H18O5/c1-19-14-9-15(22-11-12-7-5-4-6-8-12)17(21-3)16(20-2)13(14)10-18/h4-10H,11H2,1-3H3
- InChI Key: QINQKJIIDLROSJ-UHFFFAOYSA-N
- SMILES: O(CC1C=CC=CC=1)C1C=C(C(C=O)=C(C=1OC)OC)OC
Computed Properties
- Exact Mass: 302.11544
- Monoisotopic Mass: 302.11542367g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 7
- Complexity: 329
- 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: 54?2
Experimental Properties
- PSA: 53.99
Benzaldehyde, 2,3,6-trimethoxy-4-(phenylmethoxy)- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
52249-82-8 (Benzaldehyde, 2,3,6-trimethoxy-4-(phenylmethoxy)-) Related Products
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