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Home Other Building Blocks 2-Hydroxy-3-isopropyl-6-methylbenzoic acid

2-Hydroxy-3-isopropyl-6-methylbenzoic acid

CAS No.:
548-51-6
Catalog Number:
AG003HDW
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$217
- +
1g
1 week
United States
$381
- +
Product Description
Catalog Number:
AG003HDW
Chemical Name:
2-Hydroxy-3-isopropyl-6-methylbenzoic acid
CAS Number:
548-51-6
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
MDL Number:
MFCD00020270
IUPAC Name:
2-hydroxy-6-methyl-3-propan-2-ylbenzoic acid
InChI:
InChI=1S/C11H14O3/c1-6(2)8-5-4-7(3)9(10(8)12)11(13)14/h4-6,12H,1-3H3,(H,13,14)
InChI Key:
FNWNGQGTFICQJU-UHFFFAOYSA-N
SMILES:
CC(c1ccc(c(c1O)C(=O)O)C)C
EC Number:
208-949-4
UNII:
GF566F3K7L
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Assay principle for modulators of protein-protein interactions and its application to non-ATP-competitive ligands targeting protein kinase A. Analytical chemistry 20061215
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties