Cas no 76335-80-3 (Benzaldehyde, 2,4-dimethoxy-5-(phenylmethoxy)-)
76335-80-3 structure
Product Name:Benzaldehyde, 2,4-dimethoxy-5-(phenylmethoxy)-
CAS No:76335-80-3
MF:C16H16O4
MW:272.295845031738
CID:537981
PubChem ID:71403568
Update Time:2025-04-19
Benzaldehyde, 2,4-dimethoxy-5-(phenylmethoxy)- Chemical and Physical Properties
Names and Identifiers
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- Benzaldehyde, 2,4-dimethoxy-5-(phenylmethoxy)-
- 2,4-dimethoxy-5-phenylmethoxybenzaldehyde
- 5-(Benzyloxy)-2,4-dimethoxybenzaldehyde
- 76335-80-3
- DTXSID20824467
-
- Inchi： 1S/C16H16O4/c1-18-14-9-15(19-2)16(8-13(14)10-17)20-11-12-6-4-3-5-7-12/h3-10H,11H2,1-2H3
- InChI Key： ZNAZFWXZKDAEJE-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)C1C=C(C=O)C(=CC=1OC)OC
Computed Properties
- Exact Mass: 272.10488
- Monoisotopic Mass: 272.10485899g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 6
- Complexity: 288
- 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: 44.8?2
Experimental Properties
- PSA: 44.76
Benzaldehyde, 2,4-dimethoxy-5-(phenylmethoxy)- Related Literature
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
76335-80-3 (Benzaldehyde, 2,4-dimethoxy-5-(phenylmethoxy)-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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