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Merck
CN

04088

(2S,3S)-trans-3-Phenyl-2-oxiranylmethyl 4-nitrophenyl carbonate

≥98.0% (NMR)

Synonym(s):

(2S,3S)-2,3-Epoxy-3-phenylpropyl 4-nitrophenyl carbonate, (S)-NEPC, 4-Nitrophenyl (2S,3S)-2,3-epoxy-3-phenylpropyl carbonate

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About This Item

Empirical Formula (Hill Notation):
C16H13NO6
CAS Number:
147349-28-8
Molecular Weight:
315.28
NACRES:
NA.83
PubChem Substance ID:
329747877
UNSPSC Code:
12352204
MDL number:
MFCD06858332

Key Documents

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InChI

1S/C16H13NO6/c18-16(22-13-8-6-12(7-9-13)17(19)20)21-10-14-15(23-14)11-4-2-1-3-5-11/h1-9,14-15H,10H2/t14-,15-/m0/s1

SMILES string

[O-][N+](=O)c1ccc(OC(=O)OC[C@@H]2O[C@H]2c3ccccc3)cc1

InChI key

NIEXHSMFFPOGRX-GJZGRUSLSA-N

assay

≥98.0% (NMR)

form

powder

optical activity

[α]20/D −60±3°, c = 1% in methylene chloride

mp

69-72 °C

storage temp.

2-8°C

Application

suitable as substrate for epoxide hydrolase

Other Notes

Substrate for cytosolic epoxide hydrolase

Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

Regulatory Information

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E C Dietze et al.
Analytical biochemistry, 216(1), 176-187 (1994-01-01)
In this study, we demonstrate the utility of a broad class of spectrophotometric substrates for the assay of cytosolic epoxide hydrolase purified from murine liver. These substrates, epoxy esters or carbonates, cyclize spontaneously upon or during hydrolysis of the epoxide

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