CAS No.19597-07-0,1,3-Dimethyl-2-pyrrolidone Suppliers

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Basic Information

Molecular Structure:
CAS No.:	19597-07-0
Name:	1,3-Dimethyl-2-pyrrolidone
Article Data:	1

Formula:	C₆H₁₁NO
Molecular Weight:	113.159
Synonyms:	1,3-Dimethyl-2-pyrrolidinone;
Density:	0.973 g/cm³
Boiling Point:	197.6 °C at 760 mmHg
Flash Point:	85.2 °C
PSA:	20.31000
LogP:	0.42250

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Specification

The 2-Pyrrolidinone,1,3-dimethyl-, with the CAS registry number 19597-07-0, is also known as 1,3-Dimethyl-2-pyrrolidinone. It belongs to the product category of Pyrrolidines. This chemical's molecular formula is C₆H₁₁NO and molecular weight is 113.15764. Its IUPAC name is called 1,3-dimethylpyrrolidin-2-one. This chemical's classification code is Drug / Therapeutic Agent.

Physical properties of 2-Pyrrolidinone,1,3-dimethyl-: (1)ACD/LogP: 0.09; (2)#H bond acceptors: 2; (3)Index of Refraction: 1.455; (4)Molar Refractivity: 31.55 cm³; (5)Molar Volume: 116.2 cm³; (6)Surface Tension: 29.1 dyne/cm; (7)Density: 0.973 g/cm³; (8)Flash Point: 85.2 °C; (9)Enthalpy of Vaporization: 43.38 kJ/mol; (10)Boiling Point: 197.6 °C at 760 mmHg; (11)Vapour Pressure: 0.376 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1CCN(C1=O)C
(2)InChI: InChI=1S/C6H11NO/c1-5-3-4-7(2)6(5)8/h5H,3-4H2,1-2H3
(3)InChIKey: BCNBMSZKALBQEF-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	3gm/kg (3000mg/kg)		Russian Pharmacology and Toxicology Vol. 45, Pg. 122, 1982.