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346656-42-6 | 2-(2-Chlorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane
CAS No: 346656-42-6 Catalog No: AG003E78 MDL No:
Product Description
Catalog Number:
AG003E78
Chemical Name:
2-(2-Chlorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane
CAS Number:
346656-42-6
Molecular Formula:
C11H14BClO2
Molecular Weight:
224.4917
IUPAC Name:
2-(2-chlorophenyl)-5,5-dimethyl-1,3,2-dioxaborinane
InChI:
InChI=1S/C11H14BClO2/c1-11(2)7-14-12(15-8-11)9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3
InChI Key:
HTKUDRCYEPYTOR-UHFFFAOYSA-N
SMILES:
Clc1ccccc1B1OCC(CO1)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.078g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.491g/mol
Monoisotopic Mass:
224.078g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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