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Home > Boronic Acids > 121037-33-0
121037-33-0 | Boronic acid, 1-octynyl-, bis(1-methylethyl) ester
CAS No: 121037-33-0 Catalog No: AG007P9P MDL No:
Product Description
Catalog Number:
AG007P9P
Chemical Name:
Boronic acid, 1-octynyl-, bis(1-methylethyl) ester
CAS Number:
121037-33-0
Molecular Formula:
C14H27BO2
Molecular Weight:
238.1740
IUPAC Name:
oct-1-ynyl-di(propan-2-yloxy)borane
InChI:
InChI=1S/C14H27BO2/c1-6-7-8-9-10-11-12-15(16-13(2)3)17-14(4)5/h13-14H,6-10H2,1-5H3
InChI Key:
IQUFHXGHPRELDF-UHFFFAOYSA-N
SMILES:
CCCCCCC#CB(OC(C)C)OC(C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.21g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.178g/mol
Monoisotopic Mass:
238.21g/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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