CAS No.2507-61-1,(2S,4R)-4-FLUORO-PYRROLIDINE-2-CARBOXYLIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	2507-61-1
Name:	(2S,4R)-4-FLUORO-PYRROLIDINE-2-CARBOXYLIC ACID
Article Data:	1

Formula:	C₅H₈FNO₂
Molecular Weight:	133.122
Synonyms:	L-Proline,4-fluoro-, trans-;Proline, 4-fluoro-, L-trans- (8CI);trans-4-Fluoro-L-proline;trans-4-Fluoroproline;
Density:	1.309 g/cm³
Melting Point:	264°C(lit.)
Boiling Point:	265.108 °C at 760 mmHg
Flash Point:	114.133 °C
Appearance:	Colourless solid
Hazard Symbols:	Xn
Risk Codes:	22-36
Safety:	26
PSA:	49.33000
LogP:	0.09980

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Specification

The L-Proline, 4-fluoro-,(4R)-, with the CAS registry number 2507-61-1, is also known as (2S, 4R)-4-Fluoroproline. This chemical's molecular formula is C₅H₈FNO₂ and molecular weight is 133.1209. Its systematic name is called (4R)-4-fluoro-L-proline.

Physical properties of L-Proline, 4-fluoro-,(4R)-: (1)ACD/LogP: 0.06; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.473; (10)Molar Refractivity: 28.525 cm³; (11)Molar Volume: 101.731 cm³; (12)Surface Tension: 40.176 dyne/cm; (13)Density: 1.309 g/cm³; (14)Flash Point: 114.133 °C; (15)Enthalpy of Vaporization: 55.372 kJ/mol; (16)Boiling Point: 265.108 °C at 760 mmHg; (17)Vapour Pressure: 0.003 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-]C(=O)[C@H]1[NH2+]C[C@H](F)C1
(2)InChI: InChI=1/C5H8FNO2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2H2,(H,8,9)/t3-,4+/m1/s1
(3)InChIKey: ZIWHMENIDGOELV-DMTCNVIQBI