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Merck
CN

318035

(S)-(-)-α-甲氧基-α-(三氟甲基)苯乙酸

≥99%

别名:

(-)-MTPA, Mosher 酸

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线性分子式:
C6H5C(OCH3)(CF3)CO2H
化学文摘社编号:
分子量:
234.17
UNSPSC Code:
12352112
NACRES:
NA.22
PubChem Substance ID:
EC Number:
241-292-1
Beilstein/REAXYS Number:
4684048
MDL number:
Assay:
≥99%
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产品名称

(S)-(-)-α-甲氧基-α-(三氟甲基)苯乙酸, ≥99%

InChI key

JJYKJUXBWFATTE-VIFPVBQESA-N

InChI

1S/C10H9F3O3/c1-16-9(8(14)15,10(11,12)13)7-5-3-2-4-6-7/h2-6H,1H3,(H,14,15)/t9-/m0/s1

SMILES string

CO[C@](C(O)=O)(c1ccccc1)C(F)(F)F

assay

≥99%

optical activity

[α]18/D −72°, c = 1.6 in methanol

optical purity

ee: 99% (GLC)

refractive index

n20/D 1.474 (lit.)

bp

95-97 °C/0.05 mmHg (lit.)

mp

46-49 °C (lit.)

density

1.303 g/mL at 25 °C (lit.)

functional group

carboxylic acid
ether
fluoro
phenyl

storage temp.

2-8°C

Quality Level

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General description

(S)-(-)-α-甲氧基-α-(三氟甲基)苯乙酸通常用作 Mosher 酯分析和 Mosher 酰胺分析中的衍生剂,这是基于核磁共振法分别测定仲醇和胺类化合物中手性碳中心绝对构型的方法。

Other Notes

doi:10.1038/nprot.2007.354

Packaging

无底玻璃瓶。内含物在插入的融合锥体内。

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

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves


历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Mosher ester analysis for the determination of absolute configuration of stereogenic (chiral) carbinol carbons.
Hoye TR, et al.
Nature Protocols, 2(10), 2451-2458 (2007)
J Martín Torres-Valencia et al.
Phytochemical analysis : PCA, 13(6), 329-332 (2002-12-24)
A method to determine the absolute configuration of 2,3-epoxy-2-methylbutanoate ester residues in natural products is presented, based on (i) the reduction of the ester function to yield a 2-methyl-1,2-butanediol, (ii) esterification of the obtained primary alcohol with either (R)-(+)- or
Giancarlo Cravotto et al.
Chirality, 16(8), 526-533 (2004-08-04)
Cyclodextrin (CD) derivatives are important selectors for analytical chiral recognition. Their enantioselectivities and chemical properties depend on ring size and on nature, number and location of substituents. This paper describes the synthesis of 6-O-TBDMS-2,3-O-methyl beta-cyclodextrins bearing in position 2 either
Hiroshi Hasegawa et al.
Journal of mass spectrometry : JMS, 46(5), 502-507 (2011-04-19)
D-Serine is a co-agonist of the N-methyl-D-aspartate receptor in glutamate neurotransmission and has been proposed as a potential therapeutic agent for schizophrenia. However, D-serine also acts as a nephrotoxic substance in rats at high doses. To investigate the pharmacokinetics and
[Three dimensional structure analysis of organic chemical compounds from natural sources using NMR spectral analysis].
Osamu Shirota et al.
Kokuritsu Iyakuhin Shokuhin Eisei Kenkyujo hokoku = Bulletin of National Institute of Health Sciences, (121)(121), 87-88 (2004-02-24)

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