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Merck
CN

52057

(3S,4S)-(+)-1-苄基-3,4-吡咯烷二醇

≥97.0% (sum of enantiomers, HPLC)

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关于此项目

经验公式(希尔记法):
C11H15NO2
化学文摘社编号:
分子量:
193.24
UNSPSC Code:
12352005
NACRES:
NA.22
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
4992458
Assay:
≥97.0% (sum of enantiomers, HPLC)
Form:
solid
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assay

≥97.0% (sum of enantiomers, HPLC)

form

solid

optical activity

[α]20/D +33.6±3°, c = 1.05% in methanol

mp

94-100 °C

SMILES string

O[C@H]1CN(C[C@@H]1O)Cc2ccccc2

InChI

1S/C11H15NO2/c13-10-7-12(8-11(10)14)6-9-4-2-1-3-5-9/h1-5,10-11,13-14H,6-8H2/t10-,11-/m0/s1

InChI key

QJRIUWQPJVPYSO-QWRGUYRKSA-N

Application

(3S,4S)-(+)-1-Benzyl-3,4-pyrrolidinediol can be used:
  • As a building block for the preparation of novel chiral crown ethers.
  • As an intermediate in the synthesis of (3R,4R)1-benzyl-4-fluoropyrrolidin-3- amine.
  • As an intermediate in the preparation of 3-hydroxy-4-pyrrolidinyl analogs of nucleobases.

Other Notes

新型手性冠醚的结构单元

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

法规信息

新产品

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历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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H. Watanabe et al.
Reactive functional Polymers, 37, 101-101 (1998)
Synthesis of diastereomeric 3-hydroxy-4-pyrrolidinyl derivatives of nucleobases
Rejman D, et al.
Tetrahedron, 63(5), 1243-1253 (2007)
Enantiospecific Synthesis of (3R,4R)-1-Benzyl-4-fluoropyrrolidin-3-amine Utilizing a Burgess-Type Transformation
Widlicka DW, et al.
Organic Process Research & Development, 23(9), 1970-1978 (2019)
S. Cicchi et al.
Journal of the Chemical Society. Perkin Transactions 1, 1367-1367 (1998)
Synthesis and phase-transfer catalytic activity of novel chiral crown ethers immobilized onto polystyrene supports
Watanabe H, et al.
Reactive and Functional Polymers, 37(1-3), 101-109 (1998)

全球贸易项目编号

货号GTIN
52057-500MG04061832986319

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