Methyl 5-Bromo-6-methylindole-3-carboxylate - CAS 1360957-60-3
Catalog: |
BB008295 |
Product Name: |
Methyl 5-Bromo-6-methylindole-3-carboxylate |
CAS: |
1360957-60-3 |
Synonyms: |
5-bromo-6-methyl-1H-indole-3-carboxylic acid methyl ester; methyl 5-bromo-6-methyl-1H-indole-3-carboxylate |
IUPAC Name: | methyl 5-bromo-6-methyl-1H-indole-3-carboxylate |
Description: | Methyl 5-Bromo-6-methylindole-3-carboxylate (CAS# 1360957-60-3) is a useful research chemical. |
Molecular Weight: | 268.11 |
Molecular Formula: | C11H10BrNO2 |
Canonical SMILES: | CC1=C(C=C2C(=C1)NC=C2C(=O)OC)Br |
InChI: | InChI=1S/C11H10BrNO2/c1-6-3-10-7(4-9(6)12)8(5-13-10)11(14)15-2/h3-5,13H,1-2H3 |
InChI Key: | FETNEJOMKCGBMH-UHFFFAOYSA-N |
Complexity: | 259 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 266.98949 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 266.98949 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 42.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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