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Home Other Building Blocks 4-Methylsalicylic acid

4-Methylsalicylic acid

CAS No.:
50-85-1
Catalog Number:
AG003444
Molecular Formula:
C8H8O3
Molecular Weight:
152.1473
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$22
- +
100g
98%
In Stock USA
United States
$63
- +
500g
98%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG003444
Chemical Name:
4-Methylsalicylic acid
CAS Number:
50-85-1
Molecular Formula:
C8H8O3
Molecular Weight:
152.1473
MDL Number:
MFCD00002454
IUPAC Name:
2-hydroxy-4-methylbenzoic acid
InChI:
InChI=1S/C8H8O3/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4,9H,1H3,(H,10,11)
InChI Key:
NJESAXZANHETJV-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)O)C(=O)O
EC Number:
200-068-3
UNII:
4H0106V3D3
NSC Number:
16634
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.047g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
152.149g/mol
Monoisotopic Mass:
152.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
Synthesis, biological evaluation and molecular docking studies of 1,3,4-oxadiazole derivatives as potential immunosuppressive agents. Bioorganic & medicinal chemistry 20120515
A new luminescent terbium 4-methylsalicylate complex as a novel sensor for detecting the purity of methanol. Photochemistry and photobiology 20120101
Are luminescent bacteria suitable for online detection and monitoring of toxic compounds in drinking water and its sources? Analytical and bioanalytical chemistry 20110501
Identifying chelators for metalloprotein inhibitors using a fragment-based approach. Journal of medicinal chemistry 20110127
Factors that influence the response of the LysR type transcriptional regulators to aromatic compounds. BMC biochemistry 20110101
Study of liquid-liquid interfaces by an easily implemented localized NMR sequence. Magnetic resonance in chemistry : MRC 20100801
Direct injection horse urine analysis for the quantification and identification of threshold substances for doping control. III. Determination of salicylic acid by liquid chromatography/quadrupole time-of-flight mass spectrometry. Analytical and bioanalytical chemistry 20091101
Degradation of 2-methylnaphthalene by Pseudomonas sp. strain NGK1. Current microbiology 20011201
Properties