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Triphenylborane-sodium hydroxide adduct

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Name

Triphenylborane-sodium hydroxide adduct

EINECS 235-171-2
CAS No. 12113-07-4 Density 1.07 g/mL at 25 °C
PSA 23.06000 LogP 2.02600
Solubility Soluble in water Melting Point N/A
Formula C18H15B.NaOH Boiling Point N/A
Molecular Weight 282.12 Flash Point N/A
Transport Information UN 3267 Appearance N/A
Safety 26-36/37/39-45 Risk Codes 34
Molecular Structure Molecular Structure of 12113-07-4 (Triphenylborane-sodium hydroxide adduct) Hazard Symbols CorrosiveC
Synonyms

Borate(1-),hydroxytriphenyl-, sodium, (T-4)- (9CI);Sodium hydroxytriphenylborate (7CI);Sodium hydroxide, compd. with Ph3B (1:1);

 

Triphenylborane-sodium hydroxide adduct Specification

The Triphenylborane-sodium hydroxide adduct, with cas registry number 12113-07-4, belongs to the following product categories: (1)B (Classes of Boron Compounds); (2)B-Bromocatecholborane, etc.; (3)Boronic Acids and Derivatives; (4)Organometallic Reagents; (5)Others. Its systematic name and its IUPAC name are the same, which is sodium hydroxy(triphenyl)boranuide.

Physical properties about this chemical are: (1)#H bond acceptors: 1; (2)#H bond donors: 1; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 20.23 Å2.

When you are using this chemical, please be cautious about it as the following:
The Triphenylborane-sodium hydroxide adduct may cause burns. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].O[B-](c1ccccc1)(c2ccccc2)c3ccccc3
(2)InChI: InChI=1/C18H16BO.Na/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h1-15,20H;/q-1;+1
(3)InChIKey: SUZMSMLUONFLDA-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C18H16BO.Na/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18;/h1-15,20H;/q-1;+1
(5)Std. InChIKey: SUZMSMLUONFLDA-UHFFFAOYSA-N

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