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143805-78-1

143805-78-1 | 1,3,2-Dioxaborinane, 2-[4-(bromomethyl)phenyl]-5,5-dimethyl-

CAS No: 143805-78-1 Catalog No: AG001IDZ MDL No:MFCD03085921

Product Description

Catalog Number:
AG001IDZ
Chemical Name:
1,3,2-Dioxaborinane, 2-[4-(bromomethyl)phenyl]-5,5-dimethyl-
CAS Number:
143805-78-1
Molecular Formula:
C12H16BBrO2
Molecular Weight:
282.9692
MDL Number:
MFCD03085921
IUPAC Name:
2-[4-(bromomethyl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane
InChI:
InChI=1S/C12H16BBrO2/c1-12(2)8-15-13(16-9-12)11-5-3-10(7-14)4-6-11/h3-6H,7-9H2,1-2H3
InChI Key:
HIJSVCZXPKJRHJ-UHFFFAOYSA-N
SMILES:
BrCc1ccc(cc1)B1OCC(CO1)(C)C

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.043g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.972g/mol
Monoisotopic Mass:
282.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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