CAS Number5746-86-1
Synonyms3-pyrrolidin-2-yl-pyridine; EINECS 200-659-6; NORNICOTINE,DL; 2-[3-PYRIDYL]PYRROLIDINE; (±)-nor-nicotine; (2S)-2-(3-Pyridinyl)pyrrolidinium; 2-(3-pyridyl)pyrollidine; MFCD00016913; 2-[3-PYRIDYL]PYRROLIDONE; DL-NORNICOTINE; 2-(3-Pyridinyl)pyrrolidine; (R,S)-NORNICOTINE
Molecular FormulaC9H12N2
Molecular Weight148.20
Purity≥98 (TLC)%
Density1,074 g/cm3
Boiling Point107-108°C 2mm
Appearanceliquid
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 5746-86-1 |
| Catalog No. | 2A-9032136 |
| Chinese Name | (±)-降烟碱 |
| Synonyms | 3-pyrrolidin-2-yl-pyridine; EINECS 200-659-6; NORNICOTINE,DL; 2-[3-PYRIDYL]PYRROLIDINE; (±)-nor-nicotine; (2S)-2-(3-Pyridinyl)pyrrolidinium; 2-(3-pyridyl)pyrollidine; MFCD00016913; 2-[3-PYRIDYL]PYRROLIDONE; DL-NORNICOTINE; 2-(3-Pyridinyl)pyrrolidine; (R,S)-NORNICOTINE |
| Molecular Formula | C9H12N2 |
| Molecular Weight | 148.20 |
| Purity | ≥98 (TLC) |
| Density | 1,074 g/cm3 |
| Boiling Point | 107-108°C 2mm |
| Appearance | liquid |
| Water Solubility | H2O: 50 mg/mL |
| Storage Condition | 2-8℃, avoid light, keep in a cool and dry place, s |
| Packaging | III |
| HTC | 2933990090 |
| PubChem ID | 24897615 |
| MDL Number | MFCD00016913 |
| SMILES | C1CNC(C1)c2cccnc2 |
| InChI | 1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2 |
| InChI Key | MYKUKUCHPMASKF-UHFFFAOYSA-N |
| Beilstein/REAXYS | 81968 |
| NACRES Code | NA.77 |
| eCl@ss | 39151701 |
| UNSPSC | 12352210 |
| Hazard Symbols | 6.1 |
| MSDS | msds/32136_1_5746_86_1.pdf |
| Bioactivity | Target Human Endogenous Metabolite Chemical & Physical Properties Density 1,074 g/cm3 Boiling Point 107-108°C 2mm Molecular Formula C9H12N2 Molecular Weight 148.20500 Flash Point 101°C Exact Mass 148.10000 PSA 24.92000 LogP 1.83490 Index of Refraction 1.54 InChIKey MYKUKUCHPMASKF-UHFFFAOYSA-N SMILES c1cncc(C2CCCN2)c1 Storage condition 2-8°C Water Solubility H2O: 50 mg/mL |
| Use of | health and chemical hazard data given on this sheet. Store in closed vessels, refrigerated. Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data Melting point:No data Flash point:No data Molecular formula: C9H12N2 Molecular weight: 148.2 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides. Section11. Toxicological information Section12. Ecological information Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Proper shipping name: TOXIC, LIQUIDS, ORGANIC, N.O.S. OR TOXIC, LIQUIDS, ORGANIC, N.O.S. INHALA- TION HAZARD, PACKING GROUP I, ZONE A OR B (3-(Pyrrolidin-2-yl)pyridine) Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : Nicotine, 1'-demethyl-, (+-)- CAS REGISTRY NUMBER : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : MOLECULAR WEIGHT : WISWESSER LINE NOTATION : T6NJ C- BT5MTJ -+- HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 18750 ug/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intravenous SPECIES OBSERVED : Mammal - cat DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - guinea pig DOSE/DURATION : TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : Safety Information Signal Word Warning Hazard Statements H302-H312-H315-H319-H332-H335 Precautionary Statements P261-P280-P305 + P351 + P338 Personal Protective Equipment Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter Hazard Codes Xn:Harmful; RIDADR 2810 WGK Germany 3 RTECS QS6350000 Packaging Group III Hazard Class 6.1 HS Code 2933990090 Precursor & DownStream Precursor 7 CAS#:532-12-7 CAS#:1125-96-8 2-(3-Pyridinyl)... CAS#:150553-16-5 3-[1-(4-toulene... CAS#:71719-06-7 3-Bromo-5-(2-py... DownStream 9 CAS#:494-97-3 (S)-Nornicotine CAS#:7076-23-5 (R)-3-(pyrrolid... CAS#:59-67-6 Nicotinic acid CAS#:69980-24-1 (±)-nicotine-... |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 20.0% |
| Transport Info | Product name: 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% |
| Related Products in Pharmaceutical Intermediates | ||
|---|---|---|
| 5-Bromo-4-chloro-3-indolyl N-acetyl-beta-D-glucosaminide | 5609-91-6 | 2A-9032012 |
| 3-Oxabicyclo[3.1.0]hexane-2,4-dione | 5617-74-3 | 2A-9032018 |
| 3-Methyl-7-azaindole | 5654-93-3 | 2A-9032043 |
| (S)-(-)-3-Cyclohexenecarboxylic acid | 5708-19-0 | 2A-9032086 |
| (R)-3-Cyclohexenecarboxylic acid | 5709-98-8 | 2A-9032087 |
| 1-Chlorophthalazine | 5784-45-2 | 2A-9032168 |
| 5-Acetylamino-2-methoxybenzenesulfonyl chloride | 5804-73-9 | 2A-9032184 |
| 3,7-Diazabicyclo[3.3.0]octane | 5840-00-6 | 2A-9032206 |
| (R)-(-)-2-Amino-1-butanol | 5856-63-3 | 2A-9032221 |
| 4,6-Dichloro-7-azaindole | 5912-18-5 | 2A-9032261 |
| Browse all Pharmaceutical Intermediates products » | ||
Phone:
630-322-8886
630-322-8887
Email:
Office Locations:
Chicago, IL, USA
San Francisco, CA, USA
EN
SDS