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2-Nitrophenyl octyl ether

2-Nitrophenyl octyl ether structure

CAS No:
37682-29-4
Formula:
C14H21NO3
Chemical Name:
2-Nitrophenyl octyl ether
Synonyms:
Benzene,1-nitro-2-(octyloxy)-;1-Nitro-2-(octyloxy)benzene;2-Nitrophenyl octyl ether;o-Nitrophenyl octyl ether;o-Nitrophenyl n-octyl ether;o-NPOE;2-Nitrophenyl n-octyl ether;1-Nitro-2-octoxybenzene

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Description

clear yellow liquid

2-Nitrophenyl octyl ether Basic Attributes

Molecular Weight：

251.32

Exact Mass：

251.32

BRN：

2529905

EC Number：

253-623-7

DSSTox ID：

DTXSID3068047

HScode：

29093090

Characteristics

PSA：

XLogP3：

4.85730

Appearance：

Liquid

Density：

1.04 g/mL at 25 °C(lit.)

Boiling Point：

197-198 °C11 mm Hg(lit.)

Flash Point：

>230 °F

Refractive Index：

n20/D 1.508(lit.)

Water Solubility：

tetrahydrofuran: 0.1 g/mL, clear

Storage Conditions：

Flammables area

Safety Information

Packing level：

III

Hazard category：

3.2

Transport codes：

3271

wgk germany：

hazard class code：

safety instructions：

23-24/25

Drug Information

MeSH Entry Terms：

2-nitrophenyl octyl ether

2-Nitrophenyl octyl ether Use and Manufacturing

Uses

Substrates of FABMS method or SIMS method. It is the matrix of fast atom bombardment mass spectrometry and secondary ion mass spectrometer. It can also be used as a plasticizer for nitrocellulose membrane, which allows anion exchange but prevents the penetration of cations.

Manufacturing Info：

Benzene, 1-nitro-2-(octyloxy)-: ACTIVE

Computed Properties

Molecular Weight:251.32
XLogP3:5.1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:251.15214353
Monoisotopic Mass:251.15214353
Topological Polar Surface Area:55
Heavy Atom Count:18
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-NITROPHENYL OCTYL ETHER

CAS No.: 37682-29-4

Content: 99.00%

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Guide of 2-Nitrophenyl octyl ether

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
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2-Nitrophenyl octyl ether

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