CAS No.34294-79-6,(S)-3-AMINOPIPERIDINE-2-ONE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	34294-79-6
Name:	(S)-3-AMINOPIPERIDINE-2-ONE
Article Data:	1

Formula:	C₅H₁₀N₂O
Molecular Weight:	114.147
Synonyms:	2-Piperidone, 3-amino-, L- (8CI);2-Piperidinone,3-amino-, (S)-;(3S)-3-Amino-2-piperidinone;
Density:	1.071g/cm³
Melting Point:	87°C(lit.)
Boiling Point:	307.5 °C at 760 mmHg
Flash Point:	139.8 °C
Hazard Symbols:	Xn
Risk Codes:	22-36
Safety:	26
PSA:	55.12000
LogP:	0.25280

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Specification

The (S)-3-Aminopiperidine-2-one, with CAS registry number 34294-79-6, belongs to the following product categories: (1)Chiral Chemicals; (2)Chiral heterocyclic compounds. It has the systematic name of (3S)-3-aminopiperidin-2-one. And the chemical formula of this chemical is C₅H₁₀N₂O.

Physical properties of (S)-3-Aminopiperidine-2-one: (1)ACD/LogP: -2.20; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 23.55 Å²; (11)Index of Refraction: 1.476; (12)Molar Refractivity: 30.09 cm³; (13)Molar Volume: 106.5 cm³; (14)Polarizability: 11.92×10^-24cm³; (15)Surface Tension: 36.4 dyne/cm; (16)Density: 1.071 g/cm³; (17)Flash Point: 139.8 °C; (18)Enthalpy of Vaporization: 54.81 kJ/mol; (19)Boiling Point: 307.5 °C at 760 mmHg; (20)Vapour Pressure: 0.000723 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NCCC[C@@H]1N
(2)InChI: InChI=1/C5H10N2O/c6-4-2-1-3-7-5(4)8/h4H,1-3,6H2,(H,7,8)/t4-/m0/s1
(3)InChIKey: YCCMTCQQDULIFE-BYPYZUCNBE
(4)Std. InChI: InChI=1S/C5H10N2O/c6-4-2-1-3-7-5(4)8/h4H,1-3,6H2,(H,7,8)/t4-/m0/s1
(5)Std. InChIKey: YCCMTCQQDULIFE-BYPYZUCNSA-N