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26401-30-9 | Boric acid (H3BO3), triisooctyl ester
CAS No: 26401-30-9 Catalog No: AG002T32 MDL No:
Product Description
Catalog Number:
AG002T32
Chemical Name:
Boric acid (H3BO3), triisooctyl ester
CAS Number:
26401-30-9
IUPAC Name:
tris(6-methylheptyl) borate
InChI:
InChI=1S/C24H51BO3/c1-22(2)16-10-7-13-19-26-25(27-20-14-8-11-17-23(3)4)28-21-15-9-12-18-24(5)6/h22-24H,7-21H2,1-6H3
InChI Key:
XMLAPNGGLRZABE-UHFFFAOYSA-N
EC Number:
247-659-2
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
398.393g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
398.479g/mol
Monoisotopic Mass:
398.393g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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