Cas no 757995-98-5 (Benzaldehyde,4-ethoxy-2,3-dihydroxy-)
757995-98-5 structure
Product Name:Benzaldehyde,4-ethoxy-2,3-dihydroxy-
CAS No:757995-98-5
MF:C9H10O4
MW:182.173303127289
CID:562466
PubChem ID:44887021
Update Time:2025-04-19
Benzaldehyde,4-ethoxy-2,3-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde,4-ethoxy-2,3-dihydroxy-
- 2,3-Dihydroxy-4-Ethoxy-Benzaldehyde
- 4-ethoxy-2,3-dihydroxybenzaldehyde
- 2,3-DIHYDROXY-4-ETHOXYBENZALDEHYDE
- Benzaldehyde,4-ethoxy-2,3-dihydroxy
- AKOS006326873
- 4-ethoxy-2,3-bis(oxidanyl)benzaldehyde
- SCHEMBL5042464
- A838514
- 757995-98-5
- DTXSID40661255
- WOSWBATZOUYEOH-UHFFFAOYSA-N
-
- Inchi: 1S/C9H10O4/c1-2-13-7-4-3-6(5-10)8(11)9(7)12/h3-5,11-12H,2H2,1H3
- InChI Key: WOSWBATZOUYEOH-UHFFFAOYSA-N
- SMILES: O(CC)C1C=CC(C=O)=C(C=1O)O
Computed Properties
- Exact Mass: 182.05800
- Monoisotopic Mass: 182.058
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 171
- 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: 1.4
- Topological Polar Surface Area: 66.8A^2
Experimental Properties
- Density: 1.316
- Boiling Point: 310.905°C at 760 mmHg
- Flash Point: 124.763°C
- Refractive Index: 1.611
- PSA: 66.76000
- LogP: 1.30900
Benzaldehyde,4-ethoxy-2,3-dihydroxy- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
757995-98-5 (Benzaldehyde,4-ethoxy-2,3-dihydroxy-) Related Products
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