4792-58-9
Product Name:
ETHYL 5-METHOXYINDOLE-2-CARBOXYLATE
Formula:
C12H13NO3
Synonyms:
2-Carbethoxy-5-methoxyindole;2-Ethoxycarbonyl-5-methoxyindole;Ethyl 5-methoxyindole-2-carboxylate;NSC 30929
Inquiry
SAFETY INFORMATION
Signal word | Warning |
---|---|
Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. P405:Store locked up. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
Molecular Weight | 219.24 g/mol |
---|---|
XLogP3 | 3.2 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 219.08954328 g/mol |
Monoisotopic Mass | 219.08954328 g/mol |
Topological Polar Surface Area | 51.3 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 257 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Ethyl 5-methoxyindole-2-carboxylate is a natural product found in Solanum lycopersicum with data available.