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346656-34-6 | Ethyl 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
CAS No: 346656-34-6 Catalog No: AG003ER4 MDL No:
Product Description
Catalog Number:
AG003ER4
Chemical Name:
Ethyl 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
CAS Number:
346656-34-6
Molecular Formula:
C14H19BO4
Molecular Weight:
262.1093
IUPAC Name:
ethyl 2-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)benzoate
InChI:
InChI=1S/C14H19BO4/c1-4-17-13(16)11-7-5-6-8-12(11)15-18-9-14(2,3)10-19-15/h5-8H,4,9-10H2,1-3H3
InChI Key:
GZHASWCTAWNFFW-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1B1OCC(CO1)(C)C
Properties
Complexity:
309
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.138g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.112g/mol
Monoisotopic Mass:
262.138g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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