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Merck
CN

W509973

1-Methylpyrrole

≥99%

Synonym(s):

N-Methylpyrrole

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About This Item

Empirical Formula (Hill Notation):
C5H7N
CAS Number:
Molecular Weight:
81.12
NACRES:
NA.21
Flavis number:
14.023
PubChem Substance ID:
UNSPSC Code:
12164502
EC Number:
202-513-7
MDL number:
Beilstein/REAXYS Number:
104181
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InChI key

OXHNLMTVIGZXSG-UHFFFAOYSA-N

InChI

1S/C5H7N/c1-6-4-2-3-5-6/h2-5H,1H3

SMILES string

Cn1cccc1

biological source

synthetic

vapor density

2.8 (vs air)

vapor pressure

15 mmHg ( 20.2 °C)

assay

≥99%

expl. lim.

6 %

bp

112-113 °C (lit.)

mp

−57 °C (lit.)

density

0.914 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

herbaceous; woody; smoky

Quality Level

pictograms

FlameExclamation mark

signalword

Danger

Hazard Classifications

Acute Tox. 4 Oral - Flam. Liq. 2 - Skin Irrit. 2

Storage Class

3 - Flammable liquids

wgk

WGK 3

flash_point_f

60.8 °F - closed cup

flash_point_c

16 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Regulatory Information

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E E Ferapontova et al.
Biosensors & bioelectronics, 24(3), 422-428 (2008-06-11)
The molecular conformation of a synthetic branched, 4-way DNA Holliday junction (HJ) was electrochemically switched between the open and closed (stacked) conformers. Switching was achieved by electrochemically induced quantitative release of Mg(2+) ions from the oxidised poly(N-methylpyrrole) film (PPy), which
Mingyu Niu et al.
Rapid communications in mass spectrometry : RCM, 20(7), 1077-1081 (2006-02-25)
Different negative fragmentations of synthesized polyamides containing N-methylpyrrole and N-methylimidazole were analyzed by electrospray ionization tandem mass spectrometry with low-energy collision-induced dissociation. An interesting rearrangement derived from amino catalysis of N-methylimidazole was observed. The observation is useful for the study
Huihui Li et al.
Rapid communications in mass spectrometry : RCM, 20(11), 1736-1740 (2006-05-06)
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 complexes of the promoter DNA and the polyamides were investigated by electrospray ionization (ESI) mass spectrometry
Nada F Atta et al.
Analytical biochemistry, 400(1), 78-88 (2010-01-13)
An interesting electrochemical sensor has been constructed by the electrodeposition of palladium nanoclusters (Pd(nano)) on poly(N-methylpyrrole) (PMPy) film-coated platinum (Pt) electrode. Cyclic voltammetry, electrochemical impedance spectroscopy (EIS), and scanning electron microscopy were used to characterize the properties of the modified
Giovanni Piani et al.
The journal of physical chemistry. A, 113(52), 14554-14558 (2009-10-16)
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 reaction channels leading to slow and fast fragment production whose relative efficiency

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