CAS No.35123-06-9,Propanamide, 2-hydroxy-N,N-dimethyl- (9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	35123-06-9
Name:	Propanamide, 2-hydroxy-N,N-dimethyl- (9CI)
Article Data:	15

Formula:	C₅H₁₁NO₂
Molecular Weight:	117.148
Synonyms:	Lactamide,N,N-dimethyl- (6CI);N,N-Dimethyllactamide;NSC 72728;
Density:	1.034 g/cm³
Boiling Point:	200.247 °C at 760 mmHg
Flash Point:	74.907 °C
PSA:	40.54000
LogP:	-0.54460

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Specification

The 2-Hydroxy-N,N-dimethylpropanamide with cas registry number of 35123-06-9 is also known as Propanamide, 2-hydroxy-N,N-dimethyl-. It is a kind of classes of Acetylgroup. Both its systematic name and IUPAC name are the same which is called 2-hydroxy-N,N-dimethylpropanamide.

The physical properties about this chemical are: (1)ACD/LogP: -1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.19; (4)ACD/LogD (pH 7.4): -1.19; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 5.33; (8)ACD/KOC (pH 7.4): 5.33; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.45; (13)Molar Refractivity: 30.45 cm³; (14)Molar Volume: 113.3 cm³; (15)Surface Tension: 35.1 dyne/cm; (16)Density: 1.033 g/cm³; (17)Flash Point: 74.9 °C; (18)Enthalpy of Vaporization: 50.78 kJ/mol; (19)Boiling Point: 200.2 °C at 760 mmHg; (20)Vapour Pressure: 0.0815 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N(C)C)C(O)C;
(2)InChI: InChI=1/C5H11NO2/c1-4(7)5(8)6(2)3/h4,7H,1-3H3;
(3)InChIKey: YEBLAXBYYVCOLT-UHFFFAOYAM

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rat	LDLo	intraperitoneal	> 2gm/kg (2000mg/kg)		Journal of Pharmacy and Pharmacology. Vol. 11, Pg. 150, 1959.