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M78801

Sigma-Aldrich

N-Methylpyrrole

99%

Synonym(s):

1-Methyl-1H-pyrrole, N-Methylpyrrole

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About This Item

Empirical Formula (Hill Notation):
C5H7N
CAS Number:
96-54-8
Molecular Weight:
81.12
Beilstein:
104181
EC Number:
202-513-7
MDL number:
MFCD00005345
UNSPSC Code:
12352100
PubChem Substance ID:
24897193
NACRES:
NA.22

vapor density

2.8 (vs air)

vapor pressure

15 mmHg ( 20.2 °C)

Assay

99%

form

liquid

expl. lim.

6 %

bp

112-113 °C (lit.)

mp

−57 °C (lit.)

density

0.914 g/mL at 25 °C (lit.)

SMILES string

Cn1cccc1

InChI

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

InChI key

OXHNLMTVIGZXSG-UHFFFAOYSA-N

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Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Danger

Hazard Statements

H225,H302,H315

Hazard Classifications

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

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

60.8 °F - closed cup

Flash Point(C)

16 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
STBK5664
STBK1120
STBJ5589
STBH7681
WXBC3825V

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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
Gengo Kashiwazaki et al.
Bioorganic & medicinal chemistry, 17(3), 1393-1397 (2009-01-07)
We designed and synthesized alkylating conjugates 5-7 and their partner N-methylpyrrole-N-methylimidazole (PI) polyamides 8, 9. The DNA alkylating activities of conjugates 5-7 were evaluated by high-resolution denaturing polyacrylamide gel electrophoresis with a 219 base pair (bp) DNA fragment containing the
Jiang Zhou et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 11(4), 1157-1162 (2004-12-30)
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 human telomeric DNA. Of the four polyamides investigated, PyPyPygammaImImImbetaDp (3) had the highest binding affinity towards the
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
William Buchmann et al.
Journal of mass spectrometry : JMS, 44(8), 1171-1181 (2009-05-02)
A new method for the determination of the relative affinity of a ligand against various dsDNA sequences is presented by using electrospray ionization time-of-flight mass spectrometry (ESI-QTOF) mass spectrometry. The principle is described here through the complexation of double-stranded DNA
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