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Home > Boronic Acids > 1025718-99-3
1025718-99-3 | 2-Furancarboxylic acid, 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
CAS No: 1025718-99-3 Catalog No: AG0007SF MDL No:MFCD12407243
Product Description
Catalog Number:
AG0007SF
Chemical Name:
2-Furancarboxylic acid, 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
CAS Number:
1025718-99-3
Molecular Formula:
C13H19BO5
Molecular Weight:
266.0980
MDL Number:
MFCD12407243
IUPAC Name:
methyl 5-methyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carboxylate
InChI:
InChI=1S/C13H19BO5/c1-8-9(7-10(17-8)11(15)16-6)14-18-12(2,3)13(4,5)19-14/h7H,1-6H3
InChI Key:
MSHAEIHXZCDXLR-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(c(o1)C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.133g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.1g/mol
Monoisotopic Mass:
266.133g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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