4-Methylindole-6-carboxylic Acid - CAS 1545472-15-8
Catalog: |
BB011026 |
Product Name: |
4-Methylindole-6-carboxylic Acid |
CAS: |
1545472-15-8 |
Synonyms: |
4-methyl-1H-indole-6-carboxylic acid; 4-methyl-1H-indole-6-carboxylic acid |
IUPAC Name: | 4-methyl-1H-indole-6-carboxylic acid |
Description: | 4-Methylindole-6-carboxylic Acid (CAS# 1545472-15-8 ) is a useful research chemical. |
Molecular Weight: | 175.18 |
Molecular Formula: | C10H9NO2 |
Canonical SMILES: | CC1=C2C=CNC2=CC(=C1)C(=O)O |
InChI: | InChI=1S/C10H9NO2/c1-6-4-7(10(12)13)5-9-8(6)2-3-11-9/h2-5,11H,1H3,(H,12,13) |
InChI Key: | VHWGKZPWIMHYHY-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
JP-2001342242-A | Method for producing polyindole derivative and polyindole derivative obtained thereby | 20000331 |
Complexity: | 217 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 175.06332853 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.06332853 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 53.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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