Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-methyl-5-phenyl-
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Stocking Period: Inquiry
Contact: Ms Wang

76-94-8

76-94-8 structure

76-94-8 structure

Name: 2,4,6(1H,3H,5H)-Pyrimidinetrione,5-methyl-5-phenyl-
Chemical Name: 5-methyl-5-phenyl-1,3-diazinane-2,4,6-trione
CAS Number: 76-94-8
Molecular Formula: C₁₁H₁₀N₂O₃
Molecular Weight: 218.20900
Create Date: 2018-06-26 08:59:07
Modify Date: 2024-01-02 17:01:12

Name	5-methyl-5-phenyl-1,3-diazinane-2,4,6-trione
Synonyms	Methylphenylbarbital Rutonal 5-Methyl-5-phenylbarbityric acid Phenylmethylbarbituric acid Eudan 5-Phenyl-5-methylbarbituric acid 5-methyl-5-phenylbarbituric acid Heptobarbital Mephebarbital 5-methyl-5-phenyl-pyrimidine-2,4,6-trione 5-Methyl-5-phenyl-barbitursaeure

Density	1.278g/cm3
Molecular Formula	C₁₁H₁₀N₂O₃
Molecular Weight	218.20900
Exact Mass	218.06900
PSA	75.27000
LogP	0.96790
Index of Refraction	1.552

CHEMICAL IDENTIFICATION

RTECS NUMBER :: CQ7245000

CHEMICAL NAME :: Barbituric acid, 5-methyl-5-phenyl-

CAS REGISTRY NUMBER :: 76-94-8

BEILSTEIN REFERENCE NO. :: 0201825

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C11-H10-N2-O3

MOLECULAR WEIGHT :: 218.23

WISWESSER LINE NOTATION :: T6VMVMV FHJ F1 FR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Human - man

DOSE/DURATION :: 34 mg/kg

TOXIC EFFECTS :: Behavioral - excitement Behavioral - coma Nutritional and Gross Metabolic - body temperature increase

REFERENCE :: AMLSAP Acta Medicinae Legalis et Socialis. (International Academy of Legal Medicine and Social Medicine, Liege, Belgium) V.1- 1948- Volume(issue)/page/year: 10,435,1958

TYPE OF TEST :: LDLo - Lowest published lethal dose

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rabbit

DOSE/DURATION :: 350 mg/kg

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

REFERENCE :: JPPGAR Journal de Physiologie et de Pathologie Generale. (Paris, France) V.1-38, 1899-1945. For publisher information, see JOPHAN. Volume(issue)/page/year: 30,364,1932

RIDADR	UN 3249
Packaging Group	III
Hazard Class	6.1(b)

101-41-7 structure

101-41-7

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76-94-8 structure

76-94-8

Literature: Foley, Louise H; Palermo, Robert; Dunten, Pete; Wang, Ping Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 8 p. 969 - 972

65749-05-5 structure

65749-05-5

57-13-6 structure

57-13-6

~%

76-94-8 structure

76-94-8

Literature: Foley, Louise H; Palermo, Robert; Dunten, Pete; Wang, Ping Bioorganic and Medicinal Chemistry Letters, 2001 , vol. 11, # 8 p. 969 - 972

34009-61-5 structure

34009-61-5

~%

76-94-8 structure

76-94-8

Literature: Dvornik et al. Arhiv za Kemiju, 1954 , vol. 26, p. 15,17

57-13-6 structure

57-13-6

34009-61-5 structure

34009-61-5

~%

76-94-8 structure

76-94-8

Literature: Bayer and Co. Patent: DE247952 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 11, p. 926

Precursor 4
101-41-7 65749-05-5 57-13-6 34009-61-5
DownStream 0