ChemicalBook--->CAS DataBase List--->283-56-7

283-56-7

283-56-7 Structure

283-56-7 Structure
IdentificationBack Directory
[Name]

TRIETHANOLAMINE BORATE
[CAS]

283-56-7
[Synonyms]

atracort
Boratran
BORATRANE
C6H12BNO3
BRN 0774536
TRIETHANOLAMINE BORATE
TriethanolaMine borate 97%
TRIHYDROXYTRIETHYLAMINE BORATE
TRIS(HYDROXYETHYL)AMINE BORATE
2,2',2''-NITRILOTRIETHYL BORATE
2,2',2''-NITRILOTRIETHANOL BORATE
ethanol,2,2’,2’’-nitrilotri-,borate
2,2',2''-Nitrilotriethyl borate ,97%
Boric acid, tris(2-aminoethyl) ester
2,2’,2’’-nitrilotri-ethanocyclicborate
2,2μ,2μμ-Nitrilotriethyl borate, Boratrane
1-Bora-2,8,9-trioxa-5-azabicyclo[3.3.3]undecane
1-Bora-5-aza-2,8,9-trioxabicyclo[3.3.3]undecane
2,8,9-TRIOXA-5-AZA-1-BORABICYCLO(3.3.3)UNDECANE
boron,[[2,2’,2’’-nitrilotris[ethanolato]](3-)]-
4,6,11-trioxa-1-aza-5-borabicyclo[3.3.3]undecane
Boron, ((2,2',2''-nitrilotris(ethanolato))(3-))-
2,2’,2’’-nitrilotri-ethanocyclicesterwithboricacid(h3bo3)(1:1)
Ethanol, 2,2',2''-nitrilotri-, ester with boric acid (H3BO3) (1:1)
Ethanol, 2,2',2''-nitrilotri-, cyclic ester with boric acid (H3BO3) (1:1)
Ethanol, 2,2',2''-nitrilotris-, cyclic ester with boric acid (H3BO3) (1:1)
[EINECS(EC#)]

206-003-5
[Molecular Formula]

C6H12BNO3
[MDL Number]

MFCD00003272
[MOL File]

283-56-7.mol
[Molecular Weight]

156.98
Chemical PropertiesBack Directory
[Melting point ]

235-237 °C(lit.)
[Boiling point ]

149.6±39.0 °C(Predicted)
[density ]

1.13±0.1 g/cm3(Predicted)
[storage temp. ]

Room Temperature, under inert atmosphere
[solubility ]

Dimethylsulfoxide
[form ]

Powder
[pka]

6.40±0.20(Predicted)
[color ]

white
[Odor]

odorless
[BRN ]

774536
[InChI]

InChI=1S/C6H12BNO3/c1-4-9-7-10-5-2-8(1)3-6-11-7/h1-6H2
[InChIKey]

NKPKVNRBHXOADG-UHFFFAOYSA-N
[SMILES]

B12OCCN(CCO1)CCO2
[CAS DataBase Reference]

283-56-7
Hazard InformationBack Directory
[Chemical Properties]

White to off-white solid
[Uses]

Triethanolamine Borate is an intermediate in the synthesis of Silatrane (S433000) which can be used as a reversible cholinesterase inhibitor. Silatrane and its derivatives can also be used as antitumor agents.
[Preparation]

triethanolamine borate synthesis: Adding trimethyl borate into the reaction bottle62.7g (0.6mol), 74.6g (0.5mol) of triethanolamine and 300g of toluene are slowly heated to reflux for 1 hour at room temperature, then distillate is distilled out under normal pressure (65-100°C) while reaction is carried out, sampling is carried out by GC detection, after the reaction is finished, reduced pressure concentration is carried out until no liquid distillation is carried out, acetonitrile is added for recrystallization, filtration and drying are carried out, 68g of white solid is obtained, HPLC (high performance liquid chromatography) is 98.8%, and the yield is 86.6%.
[General Description]

It can be formed from the 1:1 aqueous solution of boric acid and triethanolamine.
[Safety Profile]

A poison by intravenous route.When heated to decomposition it emits toxic fumes ofNOx.
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36/37
[WGK Germany ]

3
[RTECS ]

YJ8968050
[F ]

10-21
[HS Code ]

29163990
[Toxicity]

LD ivn-mus: >100 mg/kg EJMCA5 13,207,78
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethyl acetate-->Diethyl ether-->PETROLEUM ETHER-->Toluene-->Triethanolamine-->Orthoboric acid
[Preparation Products]

SILATRANE-->Tris(2-(2-methoxyethoxy)ethyl)amine
Spectrum DetailBack Directory
[Spectrum Detail]

Triethanolamine borate(283-56-7)1HNMR
Triethanolamine borate(283-56-7)FT-IR
Triethanolamine borate(283-56-7)IR
Triethanolamine borate(283-56-7)Raman
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