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6-Nitro-1,3-benzodioxole

6-Nitro-1,3-benzodioxole structure

CAS No:
2620-44-2
Formula:
C7H5NO4
Chemical Name:
6-Nitro-1,3-benzodioxole
Synonyms:
1,3-Benzodioxole,5-nitro-;Benzene,1,2-(methylenedioxy)-4-nitro-;5-Nitro-1,3-benzodioxole;3,4-(Methylenedioxy)-1-nitrobenzene;5-Nitrobenzodioxole;1,2-(Methylenedioxy)-4-nitrobenzene;3,4-Methylenedioxynitrobenzene;4-Nitro-1,2-methylenedioxybenzene;1-Nitro-3,4-methylenedioxybenzene;NSC 5562;6-Nitro-1,3-benzodioxole;5-Nitrobenzo[d][1,3]dioxole
Categories:
Chemical Reagents > Organic Reagents

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Description

yellow fine crystalline powder

6-Nitro-1,3-benzodioxole Basic Attributes

Molecular Weight：

167.12

Exact Mass：

167.12

BRN：

169063

EC Number：

220-055-6

NSC Number：

5562

DSSTox ID：

DTXSID5062558

HScode：

2932999099

Characteristics

PSA：

64.3

XLogP3：

1.84670

Appearance：

yellow fine crystalline powder

Density：

1.486 g/cm3

Melting Point：

145 °C @ Solvent: Ethanol

Boiling Point：

278.1ºC at 760 mmHg

Flash Point：

289 °F

Refractive Index：

1.609

Water Solubility：

acetone: soluble 2.5%, clear to slightly hazy, yellow

Storage Conditions：

Store in a cool, dry place. Keep container closed when not in use.

Vapor Pressure：

0.00734mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

20/21/22

safety instructions：

Marks：

Xn,Xi

Hazard note：

Irritant

Stability/Shelf Life：

Stable under normal temperatures and pressures.

Precautionary statement(s)：

P280

Hazard Statements：

H302 + H312 + H332

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 43 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

6-Nitro-1,3-benzodioxole Use and Manufacturing

Manufacturing Info：

1,3-Benzodioxole, 5-nitro-: INACTIVE

Computed Properties

Molecular Weight:167.12
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Exact Mass:167.02185764
Monoisotopic Mass:167.02185764
Topological Polar Surface Area:64.3
Heavy Atom Count:12
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

Nitric acid

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high quality 3,4-Methylenedioxynitrobenzene 99% transparent liquid KANBEI

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