2-Methyl-1H-indole-6-carboxylic Acid - CAS 73177-33-0
Catalog: |
BB034786 |
Product Name: |
2-Methyl-1H-indole-6-carboxylic Acid |
CAS: |
73177-33-0 |
Synonyms: |
2-methyl-1H-indole-6-carboxylic acid; 2-methyl-1H-indole-6-carboxylic acid |
IUPAC Name: | 2-methyl-1H-indole-6-carboxylic acid |
Description: | 2-Methyl-1H-indole-6-carboxylic Acid (CAS# 73177-33-0) is a useful research chemical. |
Molecular Weight: | 175.18 |
Molecular Formula: | C10H9NO2 |
Canonical SMILES: | CC1=CC2=C(N1)C=C(C=C2)C(=O)O |
InChI: | InChI=1S/C10H9NO2/c1-6-4-7-2-3-8(10(12)13)5-9(7)11-6/h2-5,11H,1H3,(H,12,13) |
InChI Key: | DTOBYAWCBMAUQH-UHFFFAOYSA-N |
LogP: | 2.17450 |
Publication Number | Title | Priority Date |
WO-2021102300-A1 | Piperazine compounds for inhibiting cps1 | 20191122 |
TW-202035409-A | Monoacylglycerol lipase modulators | 20180928 |
US-2020108068-A1 | Pyrimidine derivatives | 20170518 |
US-2020179383-A1 | Phenyl derivatives as pge2 receptor modulators | 20170518 |
US-2021113559-A1 | Pyrimidine derivatives as pge2 receptor modulators | 20170518 |
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: | 2 |
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