|
|
Substance Name: Mesitene lactone
RN: 675-09-2
UNII: G2MA4KIQ1B
InChIKey: IXYLIUKQQQXXON-UHFFFAOYSA-N
Molecular Formula
- C7-H8-O2
Molecular Weight
- 124.138
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
* denotes mobile formatted website
Links to Resources
NLM Resources (File Locators)
Regulatory Agencies (Superlist Locators)
Other Resources (Internet Locators)
Search for this InChIKey on the Web
Names and Synonyms
Name of Substance
- Mesitene lactone
Synonyms
- 2,4-Dimethyl-alpha-pyrone
- 4,6-Dimethyl-2-pyrone
- 4,6-Dimethyl-alpha-pyrone
- 4,6-Dimethylcoumalin
- 5-17-09-00409 (Beilstein Handbook Reference)
- BRN 0002468
- EINECS 211-618-7
- Mesitene lactone
- NSC 402790
- UNII-G2MA4KIQ1B
Systematic Names
- 2H-Pyran-2-one, 4,6-dimethyl-
- 4,6-Dimethyl-2H-pyran-2-one
Registry Numbers
CAS Registry Number
- 675-09-2
FDA UNII
- G2MA4KIQ1B
System Generated Number
- 0000675092
Structure Descriptors
InChI
InChI=1S/C7H8O2/c1-5-3-6(2)9-7(8)4-5/h3-4H,1-2H3InChIKey
IXYLIUKQQQXXON-UHFFFAOYSA-NSmiles
CC1=CC(=CC(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 750mg/kg (750mg/kg) | Acta Pharmacologica et Toxicologica. Vol. 2, Pg. 109, 1946. |
Physical Properties
Physical Property | Value | Units | Temp (deg C) | Source |
---|---|---|---|---|
Melting Point | 51.5 | deg C | EXP | |
Boiling Point | 245 | deg C | EXP | |
log P (octanol-water) | 0.850 | (none) | EST | |
Atmospheric OH Rate Constant | 9.13E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.