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281794

Sigma-Aldrich

3-Nitrophenethyl alcohol

98%

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About This Item

Linear Formula:
O2NC6H4CH2CH2OH
CAS Number:
Molecular Weight:
167.16
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

assay

98%

form

solid

bp

141-146 °C/4 mmHg (lit.)

mp

47-50 °C (lit.)

SMILES string

OCCc1cccc(c1)[N+]([O-])=O

InChI

1S/C8H9NO3/c10-5-4-7-2-1-3-8(6-7)9(11)12/h1-3,6,10H,4-5H2

InChI key

PWZWTSYUZQZFKE-UHFFFAOYSA-N

Application

3-Nitrophenethyl alcohol has been employed as substrate to engineer nitrobenzene dioxygenase for the production of the highly potent antioxidant, hydroxytyrosol.

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

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


Certificates of Analysis (COA)

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Kalia Bernath-Levin et al.
Applied microbiology and biotechnology, 98(11), 4975-4985 (2014-01-28)
Nitrobenzene dioxygenase (NBDO) is known to add both atoms of molecular oxygen to the aromatic ring of nitrobenzene to form catechol. It is assembled by four subunits of which the alpha subunit is responsible for catalysis. As an oxidizing enzyme

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