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Trihexyl Borate

Catalog Number
ACM5337360-1
CAS Number
5337-36-0
Product Name
Trihexyl Borate
Structure
Category
Battery Materials; Electronic Materials
Synonyms
Boric Acid Trihexyl Ester
IUPAC Name
trihexyl borate
Molecular Weight
314.32
Molecular Formula
C18H39BO3
Canonical SMILES
B(OCCCCCC)(OCCCCCC)OCCCCCC
InChI
InChI=1S/C18H39BO3/c1-4-7-10-13-16-20-19(21-17-14-11-8-5-2)22-18-15-12-9-6-3/h4-18H2,1-3H3
InChI Key
KDQYHGMMZKMQAA-UHFFFAOYSA-N
Boiling Point
311 °C
Flash Point
149 °C
Purity
>98.0%(T)
Appearance
Colorless to Almost colorless clear liquid
Complexity
170
Covalently-Bonded Unit Count
1
EC Number
226-262-8
Exact Mass
314.299225g/mol
Formal Charge
0
Hazard Statements
H319 : Causes serious eye irritation.
Heavy Atom Count
22
MDL Number
MFCD00027295
Monoisotopic Mass
314.299225g/mol
NSC Number
781
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
Refractive Index
1.43
Rotatable Bond Count
18
Signal Word
Warning
Specific Gravity
0.85
UNII
9LK29O7A4Y
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