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Home > Boronic Acids > 105467-92-3
105467-92-3 | 4H-1,3,6,2-Dioxazaborocine, tetrahydro-2-hydroxy-6-octyl-
CAS No: 105467-92-3 Catalog No: AG007WEL MDL No:
Product Description
Catalog Number:
AG007WEL
Chemical Name:
4H-1,3,6,2-Dioxazaborocine, tetrahydro-2-hydroxy-6-octyl-
CAS Number:
105467-92-3
Molecular Formula:
C12H26BNO3
Molecular Weight:
243.1507
IUPAC Name:
2-hydroxy-6-octyl-1,3,6,2-dioxazaborocane
InChI:
InChI=1S/C12H26BNO3/c1-2-3-4-5-6-7-8-14-9-11-16-13(15)17-12-10-14/h15H,2-12H2,1H3
InChI Key:
ATYXDUUNUUKDNJ-UHFFFAOYSA-N
SMILES:
CCCCCCCCN1CCOB(OCC1)O
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.201g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.154g/mol
Monoisotopic Mass:
243.201g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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