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ChemicalBook--->CAS DataBase List--->13331-27-6

13331-27-6

13331-27-6 Structure

13331-27-6 Structure
IdentificationMore
[Name]

3-Nitrophenylboronic acid
[CAS]

13331-27-6
[Synonyms]

3-NITROBENZENEBORONIC ACID
3-NITROPHENYLBORIC ACID
3-NITROPHENYLBORONIC ACID
AKOS BRN-0128
M-NITROPHENYLBORONIC ACID
RARECHEM AH PB 0140
(3-nitrophenyl)-boronicaci
m-nitro-benzeneboronicaci
m-nitrobenzeneboronicacid
3-Nitrophenylboronic
3-Nitrophenylboronic Acid O2NC6H4B(OH)2
Boronic acid, (3-nitrophenyl)-
3-Nitrophenylboronic Acid (contains varying amounts of Anhydride)
[Molecular Formula]

C6H6BNO4
[MDL Number]

MFCD00007193
[Molecular Weight]

166.93
[MOL File]

13331-27-6.mol
Chemical PropertiesBack Directory
[Appearance]

White to light yellow crystal powde
[Melting point ]

284-285 °C (dec.) (lit.)
[Boiling point ]

363.3±44.0 °C(Predicted)
[density ]

1.40±0.1 g/cm3(Predicted)
[storage temp. ]

0-6°C
[solubility ]

soluble in Ethanol,Methanol,Ether
[form ]

Powder
[pka]

6.93±0.10(Predicted)
[color ]

Light yellow to pale brown
[Water Solubility ]

soluble in hot water
[Sensitive ]

Hygroscopic
[Detection Methods]

HPLC,NMR
[BRN ]

2938638
[InChIKey]

ZNRGSYUVFVNSAW-UHFFFAOYSA-N
[CAS DataBase Reference]

13331-27-6(CAS DataBase Reference)
[EPA Substance Registry System]

13331-27-6(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

CY8980000
[Hazard Note ]

Harmful
[TSCA ]

T
[HazardClass ]

IRRITANT
[HS Code ]

29310095
Raw materials And Preparation ProductsBack Directory
[Preparation Products]

6-(3-NITROPHENYL)-2-PYRIDINECARBOXALDEHYDE-->2-(3-AMINOPHENYL)PYRIDINE-->3-Bromonitrobenzene-->3-Nitrobenzyl alcohol-->3-AMINOBIPHENYL-->METHYL 3'-NITRO[1,1'-BIPHENYL]-3-CARBOXYLATE-->Benzene, 1-nitro-3-(pentyloxy)--->3'-NITRO[1,1'-BIPHENYL]-4-CARBONITRILE-->3-Aminobenzeneboronic acid-->3-NITRODIPHENYLAMINE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3-Nitrobenzeneboronic acid(13331-27-6).msds
Hazard InformationBack Directory
[Chemical Properties]

White to light yellow crystal powde
[Uses]

Catalyzes ene carbocyclization of acetylenic dicarbonyl compounds8
[Uses]

suzuki reaction
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 49, p. 5237, 1984 DOI: 10.1021/jo00200a045
Spectrum DetailBack Directory
[Spectrum Detail]

3-Nitrophenylboronic acid(13331-27-6)1HNMR
3-Nitrophenylboronic acid(13331-27-6)IR
3-Nitrophenylboronic acid(13331-27-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Nitrophenylboronic acid, 97%(13331-27-6)
[Alfa Aesar]

3-Nitrobenzeneboronic acid, 98%(13331-27-6)
[Sigma Aldrich]

13331-27-6(sigmaaldrich)
[TCI AMERICA]

3-Nitrophenylboronic Acid  (contains varying amounts of Anhydride)(13331-27-6)
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