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Home > Boronic Acids > 517874-21-4
517874-21-4 | 1,4-BENZODIOXANE-6-BORONIC ACID, PINACOL ESTER
CAS No: 517874-21-4 Catalog No: AG00D9RE MDL No:MFCD05663890
Product Description
Catalog Number:
AG00D9RE
Chemical Name:
1,4-BENZODIOXANE-6-BORONIC ACID, PINACOL ESTER
CAS Number:
517874-21-4
Molecular Formula:
C14H19BO4
Molecular Weight:
262.1093
MDL Number:
MFCD05663890
IUPAC Name:
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H19BO4/c1-13(2)14(3,4)19-15(18-13)10-5-6-11-12(9-10)17-8-7-16-11/h5-6,9H,7-8H2,1-4H3
InChI Key:
WIIBAHCYWOUFRM-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc2c(c1)OCCO2
Properties
Complexity:
328
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:
1
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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