Cas no 29865-97-2 (Benzaldehyde, 2,5-dihydroxy-4-methoxy-)
29865-97-2 structure
Product Name:Benzaldehyde, 2,5-dihydroxy-4-methoxy-
CAS No:29865-97-2
MF:C8H8O4
MW:168.146722793579
CID:1443442
PubChem ID:11686968
Update Time:2025-04-20
Benzaldehyde, 2,5-dihydroxy-4-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzaldehyde, 2,5-dihydroxy-4-methoxy-
- 2,5-dihydroxy-4-methoxybenzaldehyde
- 29865-97-2
- SCHEMBL6234401
- HTKLNVWMPNGBJV-UHFFFAOYSA-N
- DB-127462
- 2,5-dihydroxy-4-methoxy-benzaldehyde
- DTXSID90470591
-
- Inchi： 1S/C8H8O4/c1-12-8-3-6(10)5(4-9)2-7(8)11/h2-4,10-11H,1H3
- InChI Key： HTKLNVWMPNGBJV-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C(C=O)=CC=1O)O
Computed Properties
- Exact Mass: 168.04224
- Monoisotopic Mass: 168.04225873g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 159
- 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: 1.2
- Topological Polar Surface Area: 66.8?2
Experimental Properties
- PSA: 66.76
Benzaldehyde, 2,5-dihydroxy-4-methoxy- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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
29865-97-2 (Benzaldehyde, 2,5-dihydroxy-4-methoxy-) Related Products
- 86-51-1(2,3-Dimethoxybenzaldehyde)
- 66495-88-3(3-hydroxy-2-methoxybenzaldehyde)
- 5556-84-3(2,3,5-Trimethoxybenzaldehyde)
- 4460-86-0(Asaraldehyde)
- 22383-86-4(2-Hydroxy-3,4-dimethoxy-6-methylbenzaldehyde)
- 2103-57-3(2,3,4-Trimethoxybenzaldehyde)
- 148-53-8(2-Hydroxy-3-methoxybenzaldehyde)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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