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Home > Boronic Acids > 1146214-77-8
1146214-77-8 | Benzoic acid, 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
CAS No: 1146214-77-8 Catalog No: AG000EUC MDL No:MFCD19684112
Product Description
Catalog Number:
AG000EUC
Chemical Name:
Benzoic acid, 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, methyl ester
CAS Number:
1146214-77-8
Molecular Formula:
C15H21BO5
Molecular Weight:
292.1352
MDL Number:
MFCD19684112
IUPAC Name:
methyl 2-methoxy-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C15H21BO5/c1-14(2)15(3,4)21-16(20-14)10-8-7-9-11(18-5)12(10)13(17)19-6/h7-9H,1-6H3
InChI Key:
RAGDNDSTZKPURP-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(OC)cccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.148g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.138g/mol
Monoisotopic Mass:
292.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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