Cas no 24474-71-3 (Benzoic acid, 2-hydroxy-6-methoxy-, phenylmethyl ester)
24474-71-3 structure
Product Name:Benzoic acid, 2-hydroxy-6-methoxy-, phenylmethyl ester
CAS No:24474-71-3
MF:C15H14O4
MW:258.269264698029
CID:1417609
PubChem ID:6430728
Update Time:2025-04-20
Benzoic acid, 2-hydroxy-6-methoxy-, phenylmethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-hydroxy-6-methoxy-, phenylmethyl ester
- benzyl 2-hydroxy-6-methoxybenzoate
- Benzyl_2-hydroxy-6-methoxybenzoate
- 24474-71-3
- CHEMBL451295
- AKOS040757784
- CGNJMCLXIMWKDY-UHFFFAOYSA-N
- CS-0256252
- DTXSID20424007
- DA-71399
-
- Inchi： 1S/C15H14O4/c1-18-13-9-5-8-12(16)14(13)15(17)19-10-11-6-3-2-4-7-11/h2-9,16H,10H2,1H3
- InChI Key： CGNJMCLXIMWKDY-UHFFFAOYSA-N
- SMILES： O(C(C1C(=CC=CC=1OC)O)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 258.08922
- Monoisotopic Mass: 258.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 5
- Complexity: 286
- 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: 3.4
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76
Benzoic acid, 2-hydroxy-6-methoxy-, phenylmethyl ester Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
24474-71-3 (Benzoic acid, 2-hydroxy-6-methoxy-, phenylmethyl ester) Related Products
- 118-58-1(Benzyl salicylate)
- 118-61-6(Ethyl salicylate)
- 1466-82-6(Acetylsalicylic anhydride)
- 5446-02-6(Methyl 4-methoxysalicylate)
- 6290-24-0(Ethyl 2-ethoxybenzoate)
- 7335-26-4(Ethyl 2-methoxybenzoate)
- 22955-73-3(Dimethyl 4-methoxyisophthalate)
- 606-45-1(Methyl 2-methoxybenzoate)
- 2065-27-2(Methyl 2,6-dimethoxybenzoate)
- 3686-55-3(Methyl 2-ethoxybenzoate)
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