74214-62-3
Product Name:
ETHYL BETA-CARBOLINE-3-CARBOXYLATE
Formula:
C14H12N2O2
Synonyms:
β-CCE;Ethyl 9H-pyrido[3,4-b]indole-3-carboxylate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Solubility | 7.5 [ug/mL] (The mean of the results at pH 7.4) |
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Kovats Retention Index | 2656 |
SAFETY INFORMATION
Signal word | Warning |
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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. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 240.26 g/mol |
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XLogP3 | 2.9 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 240.089877630 g/mol |
Monoisotopic Mass | 240.089877630 g/mol |
Topological Polar Surface Area | 55 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 321 |
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
9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester is a member of beta-carbolines.