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(3S)-(+)-3-Fluoropyrrolidine hydrochloride

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Name

(3S)-(+)-3-Fluoropyrrolidine hydrochloride

EINECS N/A
CAS No. 136725-53-6 Density N/A
PSA 12.03000 LogP 1.44860
Solubility N/A Melting Point 183-187 °C(lit.)
Formula C4H8FN. ClH Boiling Point 143.8 °C at 760 mmHg
Molecular Weight 125.574 Flash Point 40.8 °C
Transport Information N/A Appearance N/A
Safety 26 Risk Codes 22-36/37/38
Molecular Structure Molecular Structure of 136725-53-6 ((R)-(-)-3-FLUOROPYRROLIDINE HYDROCHLORIDE) Hazard Symbols IrritantXi,HarmfulXn
Synonyms

Pyrrolidine,3-fluoro-, hydrochloride, (S)- (9CI);(3S)-3-Fluoropyrrolidine hydrochloride;(S)-(+)-3-Fluoropyrrolidinehydrochloride;

 

(3S)-(+)-3-Fluoropyrrolidine hydrochloride Specification

The Pyrrolidine, 3-fluoro-,hydrochloride (1:1), (3S)-, with its CAS registry number 136725-53-6, has the systematic name of (3S)-3-fluoropyrrolidine hydrochloride. And its product categories are including Pyrrolidines; Chiral Building Blocks; Heterocyclic Building Blocks. 

The characteristics of Pyrrolidine, 3-fluoro-,hydrochloride (1:1), (3S)- are as follows: (1)ACD/LogP: 0.09; (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: 1; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: 12.03  ; (11)Flash Point: 40.8 °C; (12)Enthalpy of Vaporization: 38.88 kJ/mol; (13)Boiling Point: 143.8 °C at 760 mmHg; (14)Vapour Pressure: 4.68 mmHg at 25°C.

When you are using this chemical, you should be very careful. For one thing, it is irritating to eyes, respiratory system and skin and may cause inflammation to the skin or other mucous membranes. If swallowed, it will be very dangerous. For another thing, it is harmful which may cause damage to health. Due to so many dangers, you could take the following instructions. If in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

What's more, the following datas could be converted into the molecular structure:
(1)SMILES:Cl.F[C@H]1CCNC1
(2)InChI:InChI=1/C4H8FN.ClH/c5-4-1-2-6-3-4;/h4,6H,1-3H2;1H/t4-;/m0./s1
(3)InChIKey:LENYOXXELREKGZ-WCCKRBBIBC

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