Methyl 5-(Benzyloxy)indole-3-acetate - CAS 5599-44-0
Catalog: |
BB029232 |
Product Name: |
Methyl 5-(Benzyloxy)indole-3-acetate |
CAS: |
5599-44-0 |
Synonyms: |
2-(5-phenylmethoxy-1H-indol-3-yl)acetic acid methyl ester; methyl 2-(5-phenylmethoxy-1H-indol-3-yl)acetate |
IUPAC Name: | methyl 2-(5-phenylmethoxy-1H-indol-3-yl)acetate |
Description: | Methyl 5-(Benzyloxy)indole-3-acetate (CAS# 5599-44-0 ) is a useful research chemical. |
Molecular Weight: | 295.33 |
Molecular Formula: | C18H17NO3 |
Canonical SMILES: | COC(=O)CC1=CNC2=C1C=C(C=C2)OCC3=CC=CC=C3 |
InChI: | InChI=1S/C18H17NO3/c1-21-18(20)9-14-11-19-17-8-7-15(10-16(14)17)22-12-13-5-3-2-4-6-13/h2-8,10-11,19H,9,12H2,1H3 |
InChI Key: | CVNVZZJUGJPNON-UHFFFAOYSA-N |
Boiling Point: | 480.8 ℃ at 760 mmHg |
Density: | 1.233 g/cm3 |
LogP: | 3.46240 |
Publication Number | Title | Priority Date |
WO-2021203007-A1 | Substituted 5-hydroxyindole compounds as modulators of alpha-1 antitrypsin | 20200403 |
EP-1620086-A1 | Compounds that modulate ppar activity and methods of preparation | 20030417 |
WO-2004091604-A1 | Compounds that modulate ppar activity and methods of preparation | 20030417 |
US-2003171588-A1 | 1,2-disubstituted-6-oxo-3-phenyl-piperidine-3-carboxamides and combinatorial libraries thereof | 20020307 |
WO-03076403-A1 | 1,2-disubstituded-6-oxo-3-phenyl-piperidine-3-carboxamides and combinatorial libraries thereof | 20020307 |
Complexity: | 367 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 295.1208434 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 295.1208434 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 51.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS