Cas no 66625-19-2 (methyl 4-hydroxy-2,6-dimethoxybenzoate)
66625-19-2 structure
Product Name:methyl 4-hydroxy-2,6-dimethoxybenzoate
CAS No:66625-19-2
MF:C10H12O5
MW:212.199283599854
CID:964295
PubChem ID:3017696
Update Time:2025-04-19
methyl 4-hydroxy-2,6-dimethoxybenzoate Chemical and Physical Properties
Names and Identifiers
-
- methyl 4-hydroxy-2,6-dimethoxybenzoate
- NS00053975
- DTXSID50985212
- EINECS 266-429-2
- LBECAGNUOFSIKD-UHFFFAOYSA-N
- METHYL 2,6-DIMETHOXY-4-HYDROXYBENZOATE
- Benzoic acid, 4-hydroxy-2,6-dimethoxy-, methyl ester
- 66625-19-2
- AKOS024323345
-
- Inchi： 1S/C10H12O5/c1-13-7-4-6(11)5-8(14-2)9(7)10(12)15-3/h4-5,11H,1-3H3
- InChI Key： LBECAGNUOFSIKD-UHFFFAOYSA-N
- SMILES： O(C)C1C=C(C=C(C=1C(=O)OC)OC)O
Computed Properties
- Exact Mass: 212.06846
- Monoisotopic Mass: 212.068473
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 204
- 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
- Topological Polar Surface Area: 65
- XLogP3: 1.4
Experimental Properties
- Density: 1.221
- Boiling Point: 367°C at 760 mmHg
- Flash Point: 145°C
- Refractive Index: 1.525
- PSA: 64.99
methyl 4-hydroxy-2,6-dimethoxybenzoate Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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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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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
66625-19-2 (methyl 4-hydroxy-2,6-dimethoxybenzoate) Related Products
- 119-36-8(Methyl salicylate)
- 2150-47-2(Methyl 2,4-dihydroxybenzoate)
- 5446-02-6(Methyl 4-methoxysalicylate)
- 22955-73-3(Dimethyl 4-methoxyisophthalate)
- 552-94-3(Salsalate)
- 606-45-1(Methyl 2-methoxybenzoate)
- 2065-27-2(Methyl 2,6-dimethoxybenzoate)
- 3686-55-3(Methyl 2-ethoxybenzoate)
- 118-55-8(Phenyl salicylate)
- 50-78-2(Aspirin)
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