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Home > Boronic Acids > 86595-38-2
86595-38-2 | Boronic acid, hexyl-, diethyl ester
CAS No: 86595-38-2 Catalog No: AG004PK6 MDL No:
Product Description
Catalog Number:
AG004PK6
Chemical Name:
Boronic acid, hexyl-, diethyl ester
CAS Number:
86595-38-2
Molecular Formula:
C10H23BO2
Molecular Weight:
186.0994
IUPAC Name:
diethoxy(hexyl)borane
InChI:
InChI=1S/C10H23BO2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h4-10H2,1-3H3
InChI Key:
JPUWPFAUCZEFGB-UHFFFAOYSA-N
SMILES:
CCCCCCB(OCC)OCC
Properties
Complexity:
92.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.179g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.102g/mol
Monoisotopic Mass:
186.179g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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