2598-31-4

2598-31-4 structure

Name: Quinacetol sulfate
Chemical Name: quinacetol sulfate
CAS Number: 2598-31-4
Molecular Formula: C₁₁H₉NO₂
Molecular Weight: 187.19500
Create Date: 2018-05-18 08:00:00
Modify Date: 2024-01-13 14:00:40
Quinacetol is a fungicide compound useful in organic synthesis.

Name	quinacetol sulfate
Synonyms	quinacetol Quinacetol sulfate 5-acetyl-8-quinolinol 1-(8-hydroxyquinolin-5-yl)ethanone Ketone,8-hydroxy-5-quinolyl methyl 5-Acetyloxine 5-Acetyl-8-hydroxyquinoline 8-Hydroxy-5-quinolyl methyl ketone quinacetol sulphate bis(5-acetyl-8-hydroxyquinolin-1-ium) sulfate 5-Acetyl-8-hydroxy-chinolin 1-(8-hydroxy-5-quinolinyl)ethanone sulfate (2:1) (salt) bis(5-acetyl-8-hydroxyquinolinium) sulfate

Density	1.275g/cm3
Boiling Point	416.5ºC at 760mmHg
Melting Point	110-112ºC
Molecular Formula	C₁₁H₉NO₂
Molecular Weight	187.19500
Flash Point	205.7ºC
Exact Mass	187.06300
PSA	50.19000
LogP	2.14300
Vapour Pressure	1.57E-07mmHg at 25°C
Index of Refraction	1.658
Storage condition	2-8°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: OB4502700

CHEMICAL NAME :: Ketone, 8-hydroxy-5-quinolyl methyl

CAS REGISTRY NUMBER :: 2598-31-4

BEILSTEIN REFERENCE NO. :: 0135793

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H9-N-O2

MOLECULAR WEIGHT :: 187.21

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 500 mg/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - changes in motor activity (specific assay)

REFERENCE :: IJPPAZ Indian Journal of Physiology and Pharmacology. (All India Institute of Medical Sciences, Dept. of Physiology, Ansari Nagar, New Delhi 110 029, India) V.1- 1957- Volume(issue)/page/year: 8,33,1964

HS Code	2933499090

148-24-3

75-36-5

~66%

2598-31-4

Literature: Koide, Yoshifumi; Hokonohara, Hisashi; Jinnai, Kuniaki; Yamada, Kimiho Bulletin of the Chemical Society of Japan, 1987 , vol. 60, # 7 p. 2327 - 2334

57434-96-5

2598-31-4

Literature: Marrugo-Gonzalez, Alonso J.; Orlov, Valerie D.; Fernandez-Maestre, Roberto Journal of the Chilean Chemical Society, 2012 , vol. 57, # 3 p. 1287 - 1291

148-24-3

2598-31-4

Literature: Marrugo-Gonzalez, Alonso J.; Orlov, Valerie D.; Fernandez-Maestre, Roberto Journal of the Chilean Chemical Society, 2012 , vol. 57, # 3 p. 1287 - 1291

2598-29-0

2598-31-4

Literature: Thakor; Shah Journal of the Indian Chemical Society, 1954 , vol. 31, p. 597

148-24-3

108-24-7

2598-31-4

Literature: Thakor; Shah Journal of the Indian Chemical Society, 1954 , vol. 31, p. 597

Precursor 5
148-24-3 75-36-5 57434-96-5 2598-29-0
108-24-7
DownStream 2
26872-48-0 39892-35-8

HS Code	2933499090
Summary	2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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