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1912-43-2 | 1H-Indole-3-acetic acid, 2-methyl-
CAS No: 1912-43-2 Catalog No: AG002F48 MDL No:MFCD00075006
Product Description
Catalog Number:
AG002F48
Chemical Name:
1H-Indole-3-acetic acid, 2-methyl-
CAS Number:
1912-43-2
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD00075006
IUPAC Name:
2-(2-methyl-1H-indol-3-yl)acetic acid
InChI:
InChI=1S/C11H11NO2/c1-7-9(6-11(13)14)8-4-2-3-5-10(8)12-7/h2-5,12H,6H2,1H3,(H,13,14)
InChI Key:
QJNNHJVSQUUHHE-UHFFFAOYSA-N
SMILES:
OC(=O)Cc1c(C)[nH]c2c1cccc2
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| Cyclooxygenase-1-selective inhibitors based on the (E)-2'-des-methyl-sulindac sulfide scaffold. | Journal of medicinal chemistry 20120308 |
| A platform of high-density INDEL/CAPS markers for map-based cloning in Arabidopsis. | The Plant journal : for cell and molecular biology 20100901 |
| Enzymatic functions of wild tomato methylketone synthases 1 and 2. | Plant physiology 20100901 |
| Free radical-scavenging activity and DNA damaging potential of auxins IAA and 2-methyl-IAA evaluated in human neutrophils by the alkaline comet assay. | Journal of biochemical and molecular toxicology 20100101 |
| Binding of ring-substituted indole-3-acetic acids to human serum albumin. | Bioorganic & medicinal chemistry 20070701 |
| 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 |
| Effect of indole-3-acetic acid derivatives on neuroepithelium in rat embryos. | The Journal of toxicological sciences 20050801 |
| Halogenated indole-3-acetic acids as oxidatively activated prodrugs with potential for targeted cancer therapy. | Bioorganic & medicinal chemistry letters 20020916 |
| Reorientation of seedlings in the earth's gravitational field induces cytosolic calcium transients. | Plant physiology 20020601 |
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