200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 887234-98-2
887234-98-2 | Benzoic acid, 3-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-,methyl ester
CAS No: 887234-98-2 Catalog No: AG00IFCP MDL No:MFCD16996352
Product Description
Catalog Number:
AG00IFCP
Chemical Name:
Benzoic acid, 3-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-,methyl ester
CAS Number:
887234-98-2
Molecular Formula:
C15H21BO4
Molecular Weight:
276.1358
MDL Number:
MFCD16996352
IUPAC Name:
methyl 3-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C15H21BO4/c1-10-8-7-9-11(13(17)18-6)12(10)16-19-14(2,3)15(4,5)20-16/h7-9H,1-6H3
InChI Key:
ZXMYLQQEDRRWOU-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.153g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.139g/mol
Monoisotopic Mass:
276.153g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.