1-Boc-5-formylindoline - CAS 879887-32-8
Catalog: |
BB038709 |
Product Name: |
1-Boc-5-formylindoline |
CAS: |
879887-32-8 |
Synonyms: |
5-formyl-2,3-dihydroindole-1-carboxylic acid tert-butyl ester; tert-butyl 5-formyl-2,3-dihydroindole-1-carboxylate |
IUPAC Name: | tert-butyl 5-formyl-2,3-dihydroindole-1-carboxylate |
Description: | 1-Boc-5-formylindoline (CAS# 879887-32-8) is a useful research chemical. |
Molecular Weight: | 247.29 |
Molecular Formula: | C14H17NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCC2=C1C=CC(=C2)C=O |
InChI: | InChI=1S/C14H17NO3/c1-14(2,3)18-13(17)15-7-6-11-8-10(9-16)4-5-12(11)15/h4-5,8-9H,6-7H2,1-3H3 |
InChI Key: | BXALJGGFHGKPIM-UHFFFAOYSA-N |
LogP: | 2.86170 |
Publication Number | Title | Priority Date |
JP-2019031496-A | Î"-diketones as activators of Wnt / β-catenin signaling pathway | 20130222 |
EP-2254863-A1 | Pesticidal condensed - ring aryl compounds | 20080314 |
JP-2009286773-A | Insecticidal condensed aryls | 20080314 |
JP-2011517663-A | Insecticidal fused-ring aryl compounds | 20080314 |
KR-101349629-B1 | Insecticidal Condensed-cyclic Aryl Compounds | 20080314 |
Complexity: | 334 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.1208434 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.1208434 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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