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41593

Sigma-Aldrich

2-Ethoxy-2-(2-naphthyl)acetonitrile

≥95.0% (HPLC)

Synonym(s):

α-Ethoxy-2-naphthaleneacetonitrile

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About This Item

Empirical Formula (Hill Notation):
C14H13NO
CAS Number:
Molecular Weight:
211.26
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:

assay

≥95.0% (HPLC)

fluorescence

λex 227 nm; λem 336 nm in methanol

SMILES string

CCOC(C#N)c1ccc2ccccc2c1

InChI

1S/C14H13NO/c1-2-16-14(10-15)13-8-7-11-5-3-4-6-12(11)9-13/h3-9,14H,2H2,1H3

InChI key

SERAXWXRCADJHK-UHFFFAOYSA-N

Application

2-Ethoxy-2-(2-naphthyl)acetonitrile is a fluorogenic substrate for use in cytochrome P450 assays.

pictograms

Environment

signalword

Warning

hcodes

pcodes

Hazard Classifications

Aquatic Acute 1

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves


Certificates of Analysis (COA)

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Alexander Zawaira et al.
Current drug metabolism, 12(7), 684-700 (2011-07-12)
The original map of mammalian cytochrome P450 (CYP450) residues involved in substrate recognition was prepared for the CYP2 family by Gotoh in 1992 by manual alignment of mammalian CYP450 residues with substrate recognition site (SRS) residues manually delimited from a
David S Wishart
Drugs in R&D, 8(6), 349-362 (2007-10-30)
Drug development is an intrinsically risky business. Like a high stakes poker game the entry costs are high and the probability of winning is low. Indeed, only a tiny percentage of lead compounds ever reach US FDA approval. At any
Alexander Zawaira et al.
Pharmacogenetics and genomics, 18(6), 467-476 (2008-05-23)
We have used maximum-likelihood models of codon substitution to investigate the role of adaptive evolution in the evolution of cytochrome P450 (CYP) sequences. Evidence for the operation of adaptive evolution in the evolution of rat CYP2C, rabbit CYP2C, rat CYP2D

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