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Name	(R)-(-)-3-Pyrrolidinol hydrochloride	EINECS	600-598-9
CAS No.	104706-47-0	Density	N/A
PSA	32.26000	LogP	0.47140
Solubility	N/A	Melting Point	104-107 °C(lit.)
Formula	C₄H₉NO^.HCl	Boiling Point	224.7 °C at 760 mmHg
Molecular Weight	123.582	Flash Point	105.8 °C
Transport Information	N/A	Appearance	N/A
Safety	26-36	Risk Codes	36/37/38
Molecular Structure		Hazard Symbols	Xi
Synonyms	R-3-Hydroxypyrrolidine Hcl; (R)-(-)-3-Pyrrolidinol Hydrochloride; (R)-3-Pyrrolidinol hydrochloride; (3R)-pyrrolidin-3-ol,hydrochloride; (R)-3-Hydroxypyrrolidine hydrochloride; (R)-(-)-3-Hydroxypyrrolidine Hydrochloride; 查看更多英文别名收起	Article Data	12

(R)-(-)-3-Pyrrolidinol hydrochloride Synthetic route

: 109431-87-0
(R)-tert-butyl 3-hydroxypyrrolidine-1-carboxylate

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

Conditions

Conditions	Yield
With hydrogenchloride In 1,4-dioxane at 20℃; for 1h;	90%
With hydrogenchloride In methanol; water at 20℃;	63%
With hydrogenchloride In ethyl acetate at 0 - 20℃;

: 130680-56-7
(3R)-N-acetyl-3-(tert-butyldimethylsilyloxy)propylamine

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

Conditions

Conditions	Yield
With hydrogenchloride for 6h; Heating;	85%

: 52334-81-3
2-chloro-5-trifluoromethylpyridine

A: 475295-14-8
1-(5-trifluoromethyl-pyridin-2-yl)-pyrrolidin-3(R)-ol

B: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

Conditions

Conditions	Yield
With potassium carbonate In ethanol; nitrogen; water	A n/a B 80.5%

: 51-35-4
4R-4-hydroxyproline

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

Conditions

Conditions	Yield
Stage #1: 4R-4-hydroxyproline In butanone; cyclohexanol at 45 - 154℃; for 5h; Stage #2: With hydrogenchloride In ethyl acetate; butanone; cyclohexanol at 0 - 25℃; for 2 - 3h; pH=1.0 - 2.0;	76%
In cyclohexene; cyclohexanol at 154℃; for 48h;	51%
Stage #1: 4R-4-hydroxyproline In cyclohexene-1-one, 2-; cyclohexanol at 155 - 160℃; for 11h; Stage #2: With hydrogenchloride In cyclohexene-1-one, 2-; ethanol; cyclohexanol at 0 - 5℃;	35%
With cyclohexenone In various solvent(s)

3-(R)-(-)-3-hydroxypyrrolidine hydrochloride: 3-(R)-(-)-3-hydroxypyrrolidine hydrochloride

: 98-59-9
p-toluenesulfonyl chloride

A: 133034-00-1
(R)-1-tosylpyrrolidin-3-ol

B: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

3-(R)-(-)-3-hydroxypyrrolidine hydrochloride: 3-(R)-(-)-3-hydroxypyrrolidine hydrochloride

: 98-59-9
p-toluenesulfonyl chloride

A: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

B: 170456-83-4
1-tosyl-3-(R)-(-)-hydroxypyrrolidine

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

: 166964-34-7
5-({[1-(4-Chloro-phenyl)-methanoyl]-amino}-methyl)-thiophene-2-sulfonyl chloride

: 4-chloro-N-[(5-{[(3R)-3-hydroxypyrrolidin-1-yl]sulfonyl}thien-2-yl)methyl]benzamide

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In DMF (N,N-dimethyl-formamide); dichloromethane	99.9%

: 24424-99-5
di-tert-butyl dicarbonate

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

: 109431-87-0
(R)-tert-butyl 3-hydroxypyrrolidine-1-carboxylate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 0 - 20℃; for 0.12h;	99%
Stage #1: (R)-3-hydroxypyrrolidine hydrochloride With triethylamine In methanol; dichloromethane at 0℃; for 0.166667h; Stage #2: di-tert-butyl dicarbonate In methanol; dichloromethane at 0 - 25℃; for 16h;	99%
With potassium carbonate In tetrahydrofuran; water	96%

: 1224944-77-7
5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

: ethyl 5-[(3R)-3-hydroxypyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxylate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In acetonitrile at 60℃; for 1h; Inert atmosphere;	98%

: 104706-47-0
(R)-3-hydroxypyrrolidine hydrochloride

: 4,6-diiodo-2-methoxypyrimidine

: (R)-1-(6-iodo-2-methoxypyrimidin-4-yl)pyrrolidin-3-ol

Conditions

Conditions	Yield
With triethylamine In isopropyl alcohol at 75℃; for 1h;	96%

(R)-(-)-3-Pyrrolidinol hydrochloride Specification

1.Introduction of (R)-(-)-3-Pyrrolidinol hydrochloride

The systematic name of R-3-Hydroxypyrrolidine hydrochloride is (3R)-pyrrolidin-3-ol hydrochloride. With the CAS registry number 104706-47-0, it is also named as (3R)-3-Pyrrolidinol hydrochloride; 3-Pyrrolidinol, (3R)-, hydrochloride (1:1). The product's categories are alcohols and derivatives, APIs intermediate, pharmacetical, chiral, pyrrole & pyrrolidine & pyrroline, benzenes, chiral building blocks, simple alcohols (chiral) and synthetic organic chemistry.

2.Properties of (R)-(-)-3-Pyrrolidinol hydrochloride

(1)ACD/LogP: -1.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -4.29; (4)ACD/LogD (pH 7.4): -3.9; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Enthalpy of Vaporization: 53.63 kJ/mol; (13)Vapour Pressure: 0.018 mmHg at 25°C.

3.Safety information of (R)-(-)-3-Pyrrolidinol hydrochloride

It is irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing.

4.Structure descriptors of (R)-(-)-3-Pyrrolidinol hydrochloride

SMILES: Cl.O[C@@H]1CCNC1;
InChI: InChI=1/C4H9NO.ClH/c6-4-1-2-5-3-4;/h4-6H,1-3H2;1H/t4-;/m1./s1;
InChIKey: QPMSJEFZULFYTB-PGMHMLKABV.

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