CAS 360-97-4|5-Amino-4-imidazolecarboxamide
Introduction：Basic information about CAS 360-97-4|5-Amino-4-imidazolecarboxamide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5-Amino-4-imidazolecarboxamide | ||
|---|---|---|---|
| CAS Number | 360-97-4 | Molecular Weight | 126.117 |
| Density | 1.8±0.1 g/cm3 | Boiling Point | 535.4±60.0 °C at 760 mmHg |
| Molecular Formula | C4H6N4O | Melting Point | 164-170 °C(lit.) |
| MSDS | ChineseUSA | Flash Point | 277.6±32.9 °C |
| Symbol | GHS07 | Signal Word | Warning |
Names
| Name | 5-Amino-4-imidazolecarboxamide |
|---|---|
| Synonym | More Synonyms |
5-Amino-4-imidazolecarboxamide BiologicalActivity
| Description | 5-Amino-3H-imidazole-4-Carboxamide (AICA) is an important precursor for the synthesis of purines in general and of the nucleobases adenine and guanine in particular. |
|---|---|
| Related Catalog | Natural Products >>OthersResearch Areas >>Others |
| Target | Human Endogenous Metabolite |
| References | [1]. YANG LIU. VARIABLE-TEMPERATURE 1 H-NMR AND AB INITIO STUDY OF 5-AMINO-IMIDAZOLE-4-CARBOXAMIDE (AICA): COMPETING PATHS FOR AMIDE-H SCRAMBLING. DECEMBER 2008. |
Chemical & Physical Properties
| Density | 1.8±0.1 g/cm3 |
|---|---|
| Boiling Point | 535.4±60.0 °C at 760 mmHg |
| Melting Point | 164-170 °C(lit.) |
| Molecular Formula | C4H6N4O |
| Molecular Weight | 126.117 |
| Flash Point | 277.6±32.9 °C |
| Exact Mass | 126.054161 |
| PSA | 97.79000 |
| LogP | -1.01 |
| Vapour Pressure | 0.0±1.5 mmHg at 25°C |
| Index of Refraction | 1.799 |
| InChIKey | DVNYTAVYBRSTGK-UHFFFAOYSA-N |
| SMILES | NC(=O)c1[nH]cnc1N |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2 gm/kg
- TOXIC EFFECTS :
- Tumorigenic - active as anti-cancer agent
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 22750 mg/kg/13W-I
- TOXIC EFFECTS :
- Liver - other changes Kidney, Ureter, Bladder - changes in bladder weight Endocrine - changes in adrenal weight
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- 2275 mg/kg/13W-I
- TOXIC EFFECTS :
- Gastrointestinal - nausea or vomiting Endocrine - changes in thymus weight Nutritional and Gross Metabolic - weight loss or decreased weight gain
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 6390 mg/kg/21W-C
- TOXIC EFFECTS :
- Tumorigenic - equivocal tumorigenic agent by RTECS criteria Kidney, Ureter, Bladder - Kidney tumors Skin and Appendages - tumors
MUTATION DATA - TYPE OF TEST :
- Mutation test systems - not otherwise specified
- TEST SYSTEM :
- Rodent - rat Cells - not otherwise specified
- DOSE/DURATION :
- 3 mmol/L
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 36,2827,1976
- TYPE OF TEST :
- Mutation test systems - not otherwise specified
- TEST SYSTEM :
- Rodent - rat Cells - not otherwise specified
- DOSE/DURATION :
- 3 mmol/L
- REFERENCE :
- CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 36,2827,1976
Safety Information
| Symbol | GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | dust mask type N95 (US);Eyeshields;Gloves |
| Hazard Codes | Xi:Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | NI3910000 |
| HS Code | 2934999090 |
Customs
| HS Code | 2934999090 |
|---|---|
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Synonyms
| 4-AMino-5-carbaMoyliMidazole |
| 4(5)-aminoimidazole-5(4)-carboxamide |
| 5-aminoimidazole-4-carboxamide |
| diazol-c |
| 5-amino-4-imidazole carboxamide |
| 4-Amino-5-imidazolecarboxamide |
| T5M CNJ DVZ EZ |
| MFCD02181040 |
| EINECS 206-641-4 |
| 4-aminoimidazole-5-carboxamide |
| ba2756 |
| 1H-Imidazole-4-carboxamide, 5-amino- |
| 5-Amino-4-imidazolecarboxamide |
| aminoimidazolecarboxamide |
| 4-amino-5-imidazolecarboxamid |
| 4-Amino-5-imodazole |
| aic |
| 4-Aminoimidzole-5-carboxamide |
| 5-Amino-Imidazole-4-carboxamide |
| 5-amino-1H-imidazole-4-carboxamide |
| 4-Amino-1H-imidazole-5-carboxamide |
| T5M CNJ DZ EVZ |
| 1H-Imidazole-4-carboximidic acid, 5-amino- |
| 5-AMINO-1H-IMIDAZOLE 4-CARBOXAMIDE |
| Dacarbazine Impurity 2 |
