Cas no 17264-90-3 (Benzoic acid,3-methoxy-, sodium salt (1:1))
17264-90-3 structure
Product Name:Benzoic acid,3-methoxy-, sodium salt (1:1)
CAS No:17264-90-3
MF:C8H7NaO3
MW:174.129153490067
CID:122206
PubChem ID:23719438
Update Time:2025-04-18
Benzoic acid,3-methoxy-, sodium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid,3-methoxy-, sodium salt (1:1)
- Sodium m-anisate
- sodium,3-methoxybenzoate
- sodium-3-methoxybenzoate
- SCHEMBL1448095
- DTXSID40635810
- VGJQQAPCRPODIU-UHFFFAOYSA-M
- sodium;3-methoxybenzoate
- sodium 3-methoxybenzoate
- 17264-90-3
-
- Inchi： 1S/C8H8O3.Na/c1-11-7-4-2-3-6(5-7)8(9)10;/h2-5H,1H3,(H,9,10);/q;+1/p-1
- InChI Key： VGJQQAPCRPODIU-UHFFFAOYSA-M
- SMILES： [Na+].O(C)C1=CC=CC(C(=O)[O-])=C1
Computed Properties
- Exact Mass: 174.02928836g/mol
- Monoisotopic Mass: 174.02928836g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 149
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 49.4?2
Benzoic acid,3-methoxy-, sodium salt (1:1) Related Literature
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
17264-90-3 (Benzoic acid,3-methoxy-, sodium salt (1:1)) Related Products
- 100-09-4(p-Anisic acid)
- 1132-21-4(3,5-Dimethoxybenzoic acid)
- 621-51-2(3-Ethoxybenzoic acid)
- 27914-54-1(4-Methoxy-d3-benzoic Acid)
- 35065-12-4(3-(4'-Hydroxy)phenoxybenzoic Acid)
- 3739-38-6(3-Phenoxybenzoic acid)
- 2215-77-2(4-Phenoxybenzoic acid)
- 586-38-9(3-Methoxybenzoic acid)
- 46331-50-4(5-Methoxyisophthalic acid)
- 2215-89-6(4,4'-Oxybis(benzoic Acid))
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