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Morpholine, 3-methyl-,(3S)- (350595-57-2)

Identification
Name:Morpholine, 3-methyl-,(3S)-
Synonyms:(3S)-3-Methylmorpholine;(S)-3-Methylmorpholine;3S-3-Methylmorpholine;Morpholine, 3-methyl-, (3S)-;
CAS:350595-57-2
Molecular Formula: C5H11NO
Molecular Weight: 101.15
InChI: InChI=1/C5H11NO/c1-5-4-7-3-2-6-5/h5-6H,2-4H2,1H3/t5-/m0/s1
Molecular Structure: (C5H11NO) (3S)-3-Methylmorpholine;(S)-3-Methylmorpholine;3S-3-Methylmorpholine;Morpholine, 3-methyl-, (3S)-;
Properties
Density:0.891g/cm3
Refractive index:1.409
Specification:

The (S)-3-Methylmorpholine, with the cas registry number 350595-57-2, has the systematic name of (3S)-3-methylmorpholine. And the molecular formula of the chemical is C5H11NO.

The characteristics of this chemical are as followings: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 0; (5)Polar Surface Area: 21.26 Å2; (6)Index of Refraction: 1.409; (7)Molar Refractivity: 28.1 cm3; (8)Molar Volume: 113.5 cm3; (9)Polarizability: 11.14×10-24cm3; (10)Surface Tension: 26.2 dyne/cm; (11)Density: 0.891 g/cm3; (12)Flash Point: 41.3 °C; (13)Enthalpy of Vaporization: 37.45 kJ/mol; (14)Boiling Point: 137.1 °C at 760 mmHg; (15)Vapour Pressure: 7.14 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CC1COCCN1
(2)InChI: InChI=1/C5H11NO/c1-5-4-7-3-2-6-5/h5-6H,2-4H2,1H3/t5-/m0/s1
(3)InChIKey: SFWWGMKXCYLZEG-YFKPBYRVBR
 

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