CAS 96-54-8|1-Methylpyrrole
Introduction：Basic information about CAS 96-54-8|1-Methylpyrrole, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-Methylpyrrole | ||
|---|---|---|---|
| CAS Number | 96-54-8 | Molecular Weight | 81.116 |
| Density | 0.9±0.1 g/cm3 | Boiling Point | 112.5±0.0 °C at 760 mmHg |
| Molecular Formula | C5H7N | Melting Point | −57 °C(lit.) |
| MSDS | ChineseUSA | Flash Point | 15.0±0.0 °C |
| Symbol | GHS02, GHS07 | Signal Word | Danger |
Names
| Name | N-Methyl pyrrole |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
|---|---|
| Boiling Point | 112.5±0.0 °C at 760 mmHg |
| Melting Point | −57 °C(lit.) |
| Molecular Formula | C5H7N |
| Molecular Weight | 81.116 |
| Flash Point | 15.0±0.0 °C |
| Exact Mass | 81.057846 |
| PSA | 4.93000 |
| LogP | 1.21 |
| Vapour density | 2.8 (vs air) |
| Vapour Pressure | 25.6±0.2 mmHg at 25°C |
| Index of Refraction | 1.484 |
| InChIKey | OXHNLMTVIGZXSG-UHFFFAOYSA-N |
| SMILES | Cn1cccc1 |
| Storage condition | 2-8°C |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATAMUTATION DATA - TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Bacteria - Bacillus subtilis
- DOSE/DURATION :
- 40600 ug/disk
- REFERENCE :
- JFAKAU Journal of the Faculty of Agriculture, Kyushu University. (Kyushu Univ., Faculty of Agriculture, 6-10-1 Hakozaki, Higashi-ku, Fukuoka, 812, Japan) V.9- 1948- Volume(issue)/page/year: 31,279,1987 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X6930 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 4354 (estimated) No. of Female Employees: 729 (estimated)
- TYPE OF TEST :
- DNA repair
- TEST SYSTEM :
- Bacteria - Bacillus subtilis
- DOSE/DURATION :
- 40600 ug/disk
- REFERENCE :
- JFAKAU Journal of the Faculty of Agriculture, Kyushu University. (Kyushu Univ., Faculty of Agriculture, 6-10-1 Hakozaki, Higashi-ku, Fukuoka, 812, Japan) V.9- 1948- Volume(issue)/page/year: 31,279,1987 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X6930 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 5 No. of Employees: 4354 (estimated) No. of Female Employees: 729 (estimated)
Safety Information
| Symbol | GHS02, GHS07 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H225-H315-H319-H335 |
| Precautionary Statements | P210-P261-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 | F:Flammable;Xn:Harmful; |
| Risk Phrases | R11;R22;R37/38 |
| Safety Phrases | S16-S26-S36-S37-S25-S23 |
| RIDADR | UN 1993 3/PG 2 |
| WGK Germany | 3 |
| RTECS | UX9640000 |
| Packaging Group | II |
| Hazard Class | 3 |
| HS Code | 29339990 |
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% |
Articles25
More Articles| New insights on the photodissociation of N-methylpyrrole: the role of stereoelectronic effects. J. Phys. Chem. A 113(52) , 14554-8, (2009) We investigated the reaction dynamics of N-methylpyrrole (NMP) along the N-CH3 coordinate, upon excitation energies below 6.4 eV. Ours and previous experiments show clearly the existence of different ... | |
| Investigation of non-covalent complexes of HIV-1 promoter DNA and polyamides containing N-methylpyrrole by electrospray ionization mass spectrometry. Rapid Commun. Mass Spectrom. 20(11) , 1736-40, (2006) Eight novel polyamides containing N-methylpyrrole were designed to target the sequence (5'-CTGCATATAAGCAG-3'/5'-CTGCTTATATGCAG-3') of the TATA box element of the HIV-1 promoter DNA. The non-covalent c... | |
| Analysis of noncovalent complexes between human telomeric DNA and polyamides containing N-methylpyrrole and N-methylimidazole by using electrospray ionization mass spectrometry. Chemistry 11(4) , 1157-62, (2005) Electrospray ionization mass spectrometry (ESI-MS) was used to investigate noncovalent complexes formed between four novel polyamides containing N-methylpyrrole (Py) and N-methylimidazole (Im), and hu... |
Synonyms
| N-Methyl pyrrole |
| EINECS 202-513-7 |
| pyrrole, N-methyl- |
| N-methylpyrrole |
| 1H-Pyrrole, 1-methyl- |
| 1-Methyl-1H-pyrrole |
| 1-Methylpyrrole |
| Pyrrole, 1-methyl- |
| MFCD00005345 |
