Methyl 1-Boc-4-methoxyindoline-6-carboxylate - CAS 928771-49-7
Catalog: |
BB040692 |
Product Name: |
Methyl 1-Boc-4-methoxyindoline-6-carboxylate |
CAS: |
928771-49-7 |
Synonyms: |
2,3-dihydroindole-1,6-dicarboxylic acid O1-tert-butyl ester O6-methyl ester; 1-O-tert-butyl 6-O-methyl 2,3-dihydroindole-1,6-dicarboxylate |
IUPAC Name: | 1-O-tert-butyl 6-O-methyl 2,3-dihydroindole-1,6-dicarboxylate |
Description: | Methyl 1-Boc-4-methoxyindoline-6-carboxylate (CAS# 928771-49-7) is a useful research chemical. |
Molecular Weight: | 307.34 |
Molecular Formula: | C16H21NO5 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2=C1C=C(C=C2)C(=O)OC |
InChI: | InChI=1S/C15H19NO4/c1-15(2,3)20-14(18)16-8-7-10-5-6-11(9-12(10)16)13(17)19-4/h5-6,9H,7-8H2,1-4H3 |
InChI Key: | NAMYXEGXVXXICU-UHFFFAOYSA-N |
MDL: | MFCD09878912 |
LogP: | 2.83580 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2006290803-A1 | Novel heterobicyclic derivatives useful as inhibitors of liver carnitine palmitoyl transferase | 20050915 |
AU-2006290803-B2 | Novel heterobicyclic derivatives useful as inhibitors of liver carnitine palmitoyl transferase | 20050915 |
BR-PI0616246-A2 | compounds, process for their manufacture, pharmaceutical compositions comprising them, method for the therapeutic and / or prophylactic treatment of diseases that are modulated by l-cpt1 inhibitors and use of the compounds | 20050915 |
EP-1926711-A1 | Novel heterobicyclic derivatives useful as inhibitors of liver carnitine palmitoyl transferase | 20050915 |
EP-1926711-B1 | Novel heterobicyclic derivatives useful as inhibitors of liver carnitine palmitoyl transferase | 20050915 |
Complexity: | 388 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 277.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 277.13140809 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 55.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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