ChemicalBook--->CAS DataBase List--->1121-07-9

1121-07-9

1121-07-9 Structure

1121-07-9 Structure
IdentificationMore
[Name]

N-METHYLSUCCINIMIDE
[CAS]

1121-07-9
[Synonyms]

1-METHYL-2,5-PYRROLIDINEDIONE
N-METHYLSUCCINIMIDE
1-methyl-5-pyrrolidinedione
1-Methyl-pyrrolidine-2,5-dione
2,5-Pyrrolidinedione,1-methyl-
N-Methylsuccinimid
Succinimide, N-methyl-
N-Methylsuccinimide, 98%+
[EINECS(EC#)]

628-414-2
[Molecular Formula]

C5H7NO2
[MDL Number]

MFCD00005517
[Molecular Weight]

113.11
[MOL File]

1121-07-9.mol
Chemical PropertiesBack Directory
[Appearance]

white crystals
[Melting point ]

61-70 °C(lit.)
[Boiling point ]

234-235 °C(lit.)
[density ]

1.2416 (rough estimate)
[refractive index ]

1.4790 (estimate)
[Fp ]

234-235°C
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

-1.34±0.20(Predicted)
[color ]

Off-White
[Sensitive ]

Moisture Sensitive
[BRN ]

110534
[InChI]

InChI=1S/C5H7NO2/c1-6-4(7)2-3-5(6)8/h2-3H2,1H3
[InChIKey]

KYEACNNYFNZCST-UHFFFAOYSA-N
[SMILES]

N1(C)C(=O)CCC1=O
[CAS DataBase Reference]

1121-07-9(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R41:Risk of serious damage to eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
[WGK Germany ]

2
[RTECS ]

UY1028650
[HS Code ]

2925.19.9100
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

white crystals
[Uses]

N-Methylsuccinimide is used as a model compound to investigate the mechanism of enolization step by density-functional theory (DFT) calculations. N-Methylsuccinimide is a metabolite of N-methyl-2-pyrrolidone (NMP) and its presence in plasma and urine can be used as a biomarker of exposure to NMP
[Synthesis Reference(s)]

Chemical and Pharmaceutical Bulletin, 31, p. 4209, 1983 DOI: 10.1248/cpb.31.4209
[General Description]

N-Methylsuccinimide is a metabolite of N-methyl-2-pyrrolidone (NMP) and its presence in in plasma and urine can be used as a biomarker of exposure to NMP. Hydrogen bonded complexes between N-methylsuccinimide and phenols (pKa = 10.2 → 6) are investigated by infrared spectrometry.
Spectrum DetailBack Directory
[Spectrum Detail]

N-METHYLSUCCINIMIDE(1121-07-9)1HNMR
N-METHYLSUCCINIMIDE(1121-07-9)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

N-Methylsuccinimide, 99%(1121-07-9)
[Alfa Aesar]

N-Methylsuccinimide, 98%(1121-07-9)
[Sigma Aldrich]

1121-07-9(sigmaaldrich)
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