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279900

(S)-(+)-2-苯基丙酸

Name: (<I>S</I>)-(+)-2-苯基丙酸
Brand: ALDRICH

97%

别名:

(S)-(+)-氢化阿托酸, (S)-HTA

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关于此项目

线性分子式:

CH₃CH(C₆H₅)CO₂H

化学文摘社编号:

7782-24-3

分子量:

150.17

UNSPSC Code:

12352002

NACRES:

NA.22

PubChem Substance ID:

24856916

MDL number:

MFCD00063139

Beilstein/REAXYS Number:

2044507

Assay:

97%

Form:

solid

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属性

assay

97%

form

solid

optical activity

[α]20/D +72°, c = 1.6 in chloroform

optical purity

ee: 98% (HPLC)

refractive index

n20/D 1.522 (lit.)

bp

115 °C/1 mmHg (lit.)

mp

29-30 °C (lit.)

density

1.1 g/mL at 25 °C (lit.)

functional group

carboxylic acid, phenyl

SMILES string

C[C@H](C(O)=O)c1ccccc1

InChI

1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m0/s1

InChI key

YPGCWEMNNLXISK-ZETCQYMHSA-N

说明

Application

手性结构单元。拆分剂

pictograms

GHS07

signalword

Warning

hcodes

H315,H317,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3

target_organs

Respiratory system

存储类别

11 - Combustible Solids

wgk

WGK 3

flash_point_f

>235.4 °F - closed cup

flash_point_c

> 113 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Faceshields, Gloves

法规信息

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Microbial metabolism of 2-arylpropionic acids: chiral inversion of ibuprofen and 2-phenylpropionic acid.

A J Hutt et al.

Chirality, 5(8), 596-601 (1993-01-01)

The metabolism of (R,S)-ibuprofen has been investigated in 24 microbial cultures. Of these Cunninghamella elegans, Mucor hiemalis, and Verticillium lecanii catalyzed the oxidation of the drug to 2-[4-(2-hydroxy-2-methylpropyl)phenyl]propionic acid, a known mammalian metabolite. The extent of metabolism was greatest with

Loading-washout studies of the stereoselective sinusoidal uptake of (R)- and (s)-2-phenylpropionyl acyl glucuronide.

David M Shackleford et al.

Current drug metabolism, 7(7), 817-826 (2006-11-01)

The vectorial movement of glucuronide conjugates from blood into bile can be an important elimination route for many drug metabolites, however the intrinsic hydrophilicity of those conjugates may conceptually act to reduce the overall efficiency of that process by limiting

Stereospecificity of enzyme induction by 2-phenylpropionic acid.

S Fournel et al.

Pharmacology & therapeutics, 33(1), 79-82 (1987-01-01)

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全球贸易项目编号

货号	GTIN
279900-1G	04061837639692
279900-250MG	04061837639708