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Home > Boronic Acids > 89188-34-1
89188-34-1 | 4H-1,3,6,2-Dioxazaborocine, 6-butyltetrahydro-2-hydroxy-
CAS No: 89188-34-1 Catalog No: AG003VZV MDL No:
Product Description
Catalog Number:
AG003VZV
Chemical Name:
4H-1,3,6,2-Dioxazaborocine, 6-butyltetrahydro-2-hydroxy-
CAS Number:
89188-34-1
Molecular Formula:
C8H18BNO3
Molecular Weight:
187.0444
IUPAC Name:
6-butyl-2-hydroxy-1,3,6,2-dioxazaborocane
InChI:
InChI=1S/C8H18BNO3/c1-2-3-4-10-5-7-12-9(11)13-8-6-10/h11H,2-8H2,1H3
InChI Key:
WULQQGVRQABFQI-UHFFFAOYSA-N
SMILES:
CCCCN1CCOB(OCC1)O
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.138g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.046g/mol
Monoisotopic Mass:
187.138g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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