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10004-44-1

10004-44-1 structure
10004-44-1 structure

Name hymexazol
Synonyms Hydroxyisoxazole
5-methyl-3-isoxazolol
Tachigaren
3(2H)-isoxazolone, 5-methyl-, compd. with 5-methyl-3-isoxazolol (1:1)
Bucide
Itachigarden
Hymexazole
5-Methylisoxazol-3(2H)-one
5-methylisoxazol-3-ol
3-Hydroxy-5-Methylisoxazole
MFCD00144468
5-methyl-1,2-oxazol-3-ol
5-methyl-3(2H)-isoxazolone
Hymexazol
5-methyl-3-hydroxyisoxazole
5-methyl-1,2-oxazol-3-one
EINECS 233-000-6
Density 1.185 g/cm3
Boiling Point 228.2ºC at 760 mmHg
Melting Point 80°C
Molecular Formula C4H5NO2
Molecular Weight 198.176
Flash Point 91.8ºC
Exact Mass 198.064056
PSA 46.00000
LogP 0.27630
Vapour Pressure 0.0493mmHg at 25°C
Index of Refraction 1.467

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NY2932000
CHEMICAL NAME :
Isoxazole, 3-hydroxy-5-methyl-
CAS REGISTRY NUMBER :
10004-44-1
LAST UPDATED :
199312
DATA ITEMS CITED :
14
MOLECULAR FORMULA :
C4-H5-N-O2
MOLECULAR WEIGHT :
99.10
WISWESSER LINE NOTATION :
T5NOJ C1 EQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3112 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>10 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1884 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1968 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1167 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
445 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Bird - chicken
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
>2 gm/m3
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Microorganism - not otherwise specified
DOSE/DURATION :
3 mg/L
REFERENCE :
NNGADV Nippon Noyaku Gakkaishi. Journal of the Pesticide Science Society of Japan. (Nippon Noyaku Gakkai, 1-43-11, Komagome, Toshima-ku, Tokyo 170, Japan) V.1- 1976- Volume(issue)/page/year: 8,173,1983
Hazard Codes Xi;Xn
Risk Phrases R22
Safety Phrases S26-S39-S61
WGK Germany 3
RTECS NY2932000
HS Code 2934999024

~71%

10004-44-1 structure

10004-44-1

Literature: Sato, Kazuo; Sugai, Soji; Tomita, Kazuo Agricultural and Biological Chemistry, 1986 , vol. 50, # 7 p. 1831 - 1838

~84%

10004-44-1 structure

10004-44-1

Literature: Oster, Timothy A.; Harris, Thomas M. Journal of Organic Chemistry, 1983 , vol. 48, # 23 p. 4307 - 4311

~82%

10004-44-1 structure

10004-44-1

Literature: McCarry; Savard Tetrahedron Letters, 1981 , vol. 22, # 51 p. 5153 - 5156

~71%

10004-44-1 structure

10004-44-1

Literature: Jacobsen; Kolind-Andersen; Christensen Canadian Journal of Chemistry, 1984 , vol. 62, # 10 p. 1940 - 1944

~14%

10004-44-1 structure

10004-44-1

Literature: Canadian Journal of Chemistry, , vol. 62, # 10 p. 1940 - 1944

~68%

10004-44-1 structure

10004-44-1

Literature: Jacobsen; Kolind-Andersen; Christensen Canadian Journal of Chemistry, 1984 , vol. 62, # 10 p. 1940 - 1944

~19%

10004-44-1 structure

10004-44-1

Literature: Kashima; Konno; Yoshiwara; Tajima Journal of Heterocyclic Chemistry, 1982 , vol. 19, # 6 p. 1535 - 1536
HS Code 2934999024
Summary HS:2934999024 5-methylisoxazol-3(2h)-one VAT:17.0% Tax rebate rate:9.0% Supervision conditions:S MFN tariff:6.5% General tariff:20.0%