Introduction：Basic information about CAS 3414-64-0|5-Nitrogramine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 5-Nitrogramine |
|---|
| CAS Number | 3414-64-0 | Molecular Weight | 219.24000 |
|---|
| Density | 1.287g/cm3 | Boiling Point | 377.9ºC at 760mmHg |
|---|
| Molecular Formula | C11H13N3O2 | Melting Point | / |
|---|
| MSDS | / | Flash Point | 182.4ºC |
|---|
Names
| Name | N,N-dimethyl-1-(5-nitro-1H-indol-3-yl)methanamine |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.287g/cm3 |
|---|
| Boiling Point | 377.9ºC at 760mmHg |
|---|
| Molecular Formula | C11H13N3O2 |
|---|
| Molecular Weight | 219.24000 |
|---|
| Flash Point | 182.4ºC |
|---|
| Exact Mass | 219.10100 |
|---|
| PSA | 64.85000 |
|---|
| LogP | 2.66090 |
|---|
| Index of Refraction | 1.661 |
|---|
| InChIKey | SVNVKGIWGOHXPW-UHFFFAOYSA-N |
|---|
| SMILES | CN(C)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- NL7710000
- CHEMICAL NAME :
- Indole, 3-((dimethylamino)methyl)-5-nitro-
- CAS REGISTRY NUMBER :
- 3414-64-0
- BEILSTEIN REFERENCE NO. :
- 0216692
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C11-H13-N3-O2
- MOLECULAR WEIGHT :
- 219.27
- WISWESSER LINE NOTATION :
- T56 BMJ D1N1&1 GNW
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 3700 ug/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PSYPAG Psychopharmacologia (Berlin). (Berlin, Ger.) V.1-46, 1959-76. For publisher information, see PSCHDL. Volume(issue)/page/year: 16,385,1970
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 2 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - ataxia
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 9,140,1966
|
Safety Information
Customs
| HS Code | 2933990090 |
|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
|---|
Synonyms
| N,N-dimethyl-5-nitro-1H-indole-3-methanamine |
| 5-Nitrogramine |
