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Substance Name: Aminothiazole [INN]
RN: 96-50-4
UNII: 5K8WKN668K
InChIKey: RAIPHJJURHTUIC-UHFFFAOYSA-N
Classification Codes
- Drug / Therapeutic Agent
- Mutation Data
Molecular Formula
- C3-H4-N2-S
Molecular Weight
- 100.145
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- 2-Aminothiazole
- Aminothiazole [INN]
Synonyms
- 2-Aminothiazole
- 2-Thiazolamine
- 2-Thiazolylamine
- 2-Thiazylamine
- 4-Thiazolin-2-onimine
- Abadol
- Abadole
- AI3-14917
- Aminothiazol
- Aminothiazol [INN-French]
- Aminothiazole
- Aminothiazolum
- Aminothiazolum [INN-Latin]
- Aminotiazol
- Aminotiazol [INN-Spanish]
- Aminotiazolo
- Aminotiazolo [DCIT]
- Basedol
- CCRIS 1279
- CP 1585
- EINECS 202-511-6
- NSC 1900
- RP 2921
- UNII-5K8WKN668K
- USAF EK-P-5501
Systematic Names
- 2-Aminothiazole
- 2-Thiazolamine
- Aminothiazole
- Thiazole, 2-amino-
Registry Numbers
CAS Registry Number
- 96-50-4
FDA UNII
- 5K8WKN668K
Other Registry Numbers
- 5654-01-3
- 58473-79-3
Related Registry Numbers
- 57530-25-3 (mononitrate)
- 63589-20-8 (sulfate[1:1])
System Generated Number
- 0000096504
Structure Descriptors
InChI
1S/C3H4N2S/c4-3-5-1-2-6-3/h1-2H,(H2,4,5)InChIKey
RAIPHJJURHTUIC-UHFFFAOYSA-NSmiles
c1(nccs1)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| cat | LDLo | oral | 120mg/kg (120mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: COMA BEHAVIORAL: TREMOR | Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 71, 1948. |
| guinea pig | LDLo | oral | 120mg/kg (120mg/kg) | BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: TREMOR | Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 71, 1948. |
| mouse | LD50 | intraperitoneal | 200mg/kg (200mg/kg) | National Technical Information Service. Vol. AD277-689, | |
| rabbit | LD50 | oral | 370mg/kg (370mg/kg) | BEHAVIORAL: TREMOR BEHAVIORAL: COMA LUNGS, THORAX, OR RESPIRATION: DYSPNEA | Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 71, 1948. |
| rat | LD50 | intravenous | 570mg/kg (570mg/kg) | Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 211, Pg. 367, 1950. | |
| rat | LD50 | oral | 480mg/kg (480mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: COMA BEHAVIORAL: TREMOR | Journal of Industrial Hygiene and Toxicology. Vol. 30, Pg. 71, 1948. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 93 | deg C | EXP | |
| pKa Dissociation Constant | 5.36 | (none) | EXP | |
| log P (octanol-water) | 0.38 | (none) | EXP | |
| Water Solubility | 5.53E+04 | mg/L | 25 | EST |
| Vapor Pressure | 0.243 | mm Hg | 25 | EST |
| Henry's Law Constant | 1.35E-09 | atm-m3/mole | 25 | EST |
| Atmospheric OH Rate Constant | 7.73E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.