CAS 1004-36-0|2,6-Dimethyl-γ-pyrone

Introduction：Basic information about CAS 1004-36-0|2,6-Dimethyl-γ-pyrone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. 2,6-Dimethyl-γ-pyrone BiologicalActivity
3. Chemical & Physical Properties
4. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
5. Safety Information
6. Customs
7. Articles1
8. Synonyms

Common Name	2,6-Dimethyl-γ-pyrone
CAS Number	1004-36-0	Molecular Weight	124.14
Density	1.1±0.1 g/cm3	Boiling Point	249.0±0.0 °C at 760 mmHg
Molecular Formula	C₇H₈O₂	Melting Point	133-137 °C(lit.)
MSDS	ChineseUSA	Flash Point	103.4±12.3 °C
Symbol	GHS07	Signal Word	Warning

Names

Name	2,6-Dimethyl-4H-pyran-4-one
Synonym	More Synonyms

2,6-Dimethyl-γ-pyrone BiologicalActivity

Description	2,6-Dimethyl-4H-pyran-4-one is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog	Research Areas >>Others
In Vitro	2,6-Dimethyl-4-pyrone 用作化学和有机中间体。可用于农药、医药、染料等领域。

Chemical & Physical Properties

Density	1.1±0.1 g/cm3
Boiling Point	249.0±0.0 °C at 760 mmHg
Melting Point	133-137 °C(lit.)
Molecular Formula	C₇H₈O₂
Molecular Weight	124.14
Flash Point	103.4±12.3 °C
Exact Mass	124.052429
PSA	30.21000
LogP	0.10
Vapour Pressure	0.0±0.5 mmHg at 25°C
Index of Refraction	1.485

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UQ0780000

CHEMICAL NAME :: 4H-Pyran-4-one, 2,6-dimethyl-

CAS REGISTRY NUMBER :: 1004-36-0

BEILSTEIN REFERENCE NO. :: 0107418

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C7-H8-O2

MOLECULAR WEIGHT :: 124.15

WISWESSER LINE NOTATION :: T6O DVJ B1 F1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1670 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: SKEZAP Shokuhin Eiseigaku Zasshi. Food Hygiene Journal. (Nippon Shokuhin Eisei Gakkai c/o Shokuhin Eisei Senta, 2-6-1 Jingumae, Shibuya-ku, Tokyo 150, Japan) V.1- 1960- Volume(issue)/page/year: 12,520,1971

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 56 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#01722

Safety Information

Symbol	GHS07
Signal Word	Warning
Hazard Statements	H302
Personal Protective Equipment	dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes	Xn:Harmful;
Risk Phrases	R22
Safety Phrases	S36/37
RIDADR	NONH for all modes of transport
WGK Germany	3
RTECS	UQ0780000
HS Code	29329995

Customs

HS Code	2932999099
Summary	2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Articles1

In silico identification and biochemical characterization of novel inhibitors of NQO1.

Bioorg. Med. Chem. Lett. 16 , 6246-54, (2006)

From in silico docking and COMPARE analysis, novel inhibitors of human NAD(P)H quinone oxidoreductase (NQO1) have been identified from the NCI compound database, the most potent of which has an observ...

Synonyms

4H-Pyran-4-one, 2,6-dimethyl-

EINECS 213-719-1

2,6-dimethyl-4-pyrone

2,6-Dimethyl-γ-pyrone

2,6-dimethylpyran-4-one

2,6-Dimethyl-Gamma-Pyrone

2,6-Dimethyl-4H-pyran-4-one

MFCD00006579

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