ChemicalBook > CAS DataBase List > 1-BENZYLPYRROLIDIN-3-YL-METHANOL

1-BENZYLPYRROLIDIN-3-YL-METHANOL

Product Name
1-BENZYLPYRROLIDIN-3-YL-METHANOL
CAS No.
5731-17-9
Chemical Name
1-BENZYLPYRROLIDIN-3-YL-METHANOL
Synonyms
CHEMBRDG-BB 4003810;1-BENZYL-DL-BETA-PROLINOL;1-Benzylpyrrolidine-3-methanol;1-Benzyl-3-pyrrolidinemethanol;1-BENZYL-3-PYRROLIDIN-3-YLMETHANOL;1-BENZYL-3-HYDROXYMETHYLPYRROLIDINE;1-Benzyl-1H-pyrrolidin-3-yl-Methanol;(1-Benzyl-1H-pyrrolidin-3-yl)Methanol;3-HYDROXYMETHYL-N-BENZYL- PYRROLIDINE;1-(Phenylmethyl)-3-pyrrolidinemethanol
CBNumber
CB2194664
Molecular Formula
C12H17NO
Formula Weight
191.27
MOL File
5731-17-9.mol
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1-BENZYLPYRROLIDIN-3-YL-METHANOL Property

Boiling point:
129 °C(Press: 0.9 Torr)
Density 
1.082±0.06 g/cm3(Predicted)
storage temp. 
Store at room temperature
form 
solid
pka
14.93±0.10(Predicted)
Appearance
Light yellow to yellow Viscous liquid
InChI
InChI=1S/C12H17NO/c14-10-12-6-7-13(9-12)8-11-4-2-1-3-5-11/h1-5,12,14H,6-10H2
InChIKey
QPQQBJDSKDWQMJ-UHFFFAOYSA-N
SMILES
N1(CC2=CC=CC=C2)CCC(CO)C1
CAS DataBase Reference
5731-17-9(CAS DataBase Reference)
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Safety

Hazard Codes 
Xi,T
Risk Statements 
25
Safety Statements 
45
RIDADR 
UN 2811 6.1 / PGIII
WGK Germany 
3
HazardClass 
IRRITANT
HS Code 
2933998090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H301Toxic if swalloed

Precautionary statements

P301+P310IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
ADE000012
Product name
1-Benzylpyrrolidin-3-yl-methanol
Purity
Aldrich
Packaging
1g
Price
$179
Updated
2025/07/31
TRC
Product number
B289065
Product name
(1-Benzylpyrrolidin-3-yl)methanol
Packaging
100mg
Price
$75
Updated
2021/12/16
Matrix Scientific
Product number
018164
Product name
1-Benzylpyrrolidin-3-yl-methanol
Packaging
1g
Price
$37
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB50914
Product name
1-Benzylpyrrolidin-3-yl-methanol
Packaging
250mg
Price
$65
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB50914
Product name
1-Benzylpyrrolidin-3-yl-methanol
Packaging
500mg
Price
$100
Updated
2021/12/16
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1-BENZYLPYRROLIDIN-3-YL-METHANOL Chemical Properties,Usage,Production

Synthesis

51535-00-3

5731-17-9

Example A: Synthesis of N-benzyl-3-hydroxymethylpyrrolidine Step a: Reduction of methyl 1-benzyl-5-oxopyrrolidine-3-carboxylate to 1-benzyl-3-hydroxymethylpyrrolidine Under an inert atmosphere, methyl 1-benzyl-5-oxopyrrolidine-3-carboxylate (1.0 equiv, commercially available) was dissolved in toluene and the mixture was cooled to 0 °C. To the cooled mixture was slowly added a dimethyl sulfide solution of borane-dimethyl sulfide complex (3.75 equiv.). The reaction mixture was heated to 100°C-110°C and refluxed for 16 hours. Upon completion of the reaction, the mixture was cooled to room temperature, further cooled to -5 °C to -10 °C, and then sodium bicarbonate solution was added dropwise. The mixture was slowly warmed to room temperature and then refluxed for 2 hours. After the reaction mixture was cooled, the organic layer was separated and the aqueous layer was extracted with toluene. The combined toluene layers were washed sequentially with water and brine. Finally, the organic solvent was removed by evaporation under reduced pressure to afford the target product N-benzyl-3-hydroxymethylpyrrolidine in 99.14% yield.

References

[1] Patent: WO2006/18708, 2006, A2. Location in patent: Page/Page column 21-22
[2] Letters in Organic Chemistry, 2011, vol. 8, # 3, p. 155 - 162
[3] Patent: US2004/147502, 2004, A1. Location in patent: Page/Page column 36-37
[4] Organic Letters, 1999, vol. 1, # 5, p. 799 - 801
[5] Patent: US2005/165005, 2005, A1. Location in patent: Page/Page column 59-60

1-BENZYLPYRROLIDIN-3-YL-METHANOL Preparation Products And Raw materials

Raw materials

Preparation Products

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1-BENZYLPYRROLIDIN-3-YL-METHANOL Suppliers

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View Lastest Price from 1-BENZYLPYRROLIDIN-3-YL-METHANOL manufacturers

Career Henan Chemical Co
Product
1-BENZYLPYRROLIDIN-3-YL-METHANOL 5731-17-9
Price
US $1.00/KG
Min. Order
1KG
Purity
98%
Supply Ability
100KG
Release date
2018-12-25
Career Henan Chemical Co
Product
1-BENZYLPYRROLIDIN-3-YL-METHANOL 5731-17-9
Price
US $1.00/kg
Min. Order
1kg
Purity
95%-99%
Supply Ability
100kg
Release date
2018-12-25

5731-17-9, 1-BENZYLPYRROLIDIN-3-YL-METHANOLRelated Search:


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