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22238-17-1

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Basic Information
CAS No.: 22238-17-1
Name: TRI-SEC-BUTYL BORATE
Article Data: 19
Molecular Structure:
Molecular Structure of 22238-17-1 (TRI-SEC-BUTYL BORATE)
Formula: C12H27 B O3
Molecular Weight: 230.156
Synonyms: Boric acid(H3BO3), tris(1-methylpropyl) ester (9CI); Boric acid, tri-sec-butyl ester(8CI); sec-Butyl borate (6CI,7CI); Boron tri-sec-butoxide;Tri-sec-butoxyborane; Tri-sec-butyl borate; Tri-sec-butyl orthoborate
Density: 0.856g/cm3
Boiling Point: 193.3°Cat760mmHg
Flash Point: 43.7°C
Safety: Moderately toxic by ingestion. An eye irritant. Combustible when exposed to heat or flame; can react with oxidizing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also BORON COMPOUNDS and sec-BUTYL ALCOHOL.
PSA: 27.69000
LogP: 3.41660
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Chemistry

Product Name: Tri-sec-butyl borate (CAS NO.22238-17-1)


Molecular Formula: C12H27BO3
Molecular Weight: 230.15198g/mol
Mol File: 22238-17-1.mol
Einecs: 244-862-8
Boiling point: 193.3 °C at 760 mmHg
Flash Point: 43.7 °C
Density: 0.856 g/cm3
Sensitive: Moisture-sensitive
Surface Tension: 24.4 dyne/cm
Enthalpy of Vaporization: 41.19 kJ/mol
Vapour Pressure: 0.652 mmHg at 25°C
H-Bond Donor: 0
H-Bond Acceptor: 3
Rotatable Bond Count: 9
Topological Polar Surface Area: 27.7
Heavy Atom Count: 16
Complexity: 138
Undefined Atom StereoCenter Count: 3
Covalently-Bonded Unit Count: 1 

Toxicity Data With Reference

1.    

eye-rbt 100 mg MLD

     14KTAK    Boron, Metallo-Boron Compounds and Boranes R.M. Adams,New York, NY.: Wiley,1964,706.
2.    

orl-mus LD50:2100 mg/kg

     14KTAK    Boron, Metallo-Boron Compounds and Boranes R.M. Adams,New York, NY.: Wiley,1964,706.

Safety Profile

Moderately toxic by ingestion. An eye irritant. Combustible when exposed to heat or flame; can react with oxidizing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also BORON COMPOUNDS and sec-BUTYL ALCOHOL.

Specification

 Tri-sec-butyl borate ,its CAS NO. is 22238-17-1,the synonyms is Boric acid tris(sec-butyl) ester ; sec-Butyl Borate (6CI,7CI) ; Tri-sec-butyl orthoborate ; 4-01-00-01577 (Beilstein Handbook Reference) .