1830-54-2
Product Name:
Dimethyl 1,3-acetonedicarboxylate
Formula:
C7H10O5
Synonyms:
Dimethyl-3-oxoglutarate
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CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Light yellow liquid; [Sigma-Aldrich MSDS] |
|---|---|
| Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H317:Sensitisation, Skin |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P272:Contaminated work clothing should not be allowed out of the workplace. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P333+P313:IF SKIN irritation or rash occurs: Get medical advice/attention. |
COMPUTED DESCRIPTORS
| Molecular Weight | 174.15 g/mol |
|---|---|
| XLogP3 | 0 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 6 |
| Exact Mass | 174.05282342 g/mol |
| Monoisotopic Mass | 174.05282342 g/mol |
| Topological Polar Surface Area | 69.7 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 176 |
| 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
4(R),8-dimethyl-trans-2-nonenoyl-CoA is an oxo carboxylic acid.