610-88-8
Product Name:
TENUAZONIC ACID COPPER FROM ALTERNARIA A
Formula:
C10H15NO3
Synonyms:
(S)-3-Acetyl-5-(S)-sec-butyltetramic acid;(S)-3-Acetyl-5-sec-butyl-4-hydroxy-3-pyrrolin-2-one;(5S)-3-Acetyl-1,5-dihydro-4-hydroxy-5-[(1S)-1-methylpropyl]-2H-pyrrol-2-one;3-Acetyl-5-sec-butyl-4-hydroxy-3-pyrrolin-2-one
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CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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Melting Point | 74 - 75.5 °C |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 |
GHS Hazard Statements |
H301:Acute toxicity,oral |
Precautionary Statement Codes |
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. |
COMPUTED DESCRIPTORS
Molecular Weight | 197.23 g/mol |
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XLogP3 | 1.2 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 197.10519334 g/mol |
Monoisotopic Mass | 197.10519334 g/mol |
Topological Polar Surface Area | 66.4 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 307 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Tenuazonic acid is a natural product found in Pyricularia oryzae, Alternaria, and Alternaria alternata with data available.