200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1980783-96-7
1980783-96-7 | 2-CHLORO-6-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-BENZOIC ACID METHYL ESTER
CAS No: 1980783-96-7 Catalog No: AG01E655 MDL No:
Product Description
Catalog Number:
AG01E655
Chemical Name:
2-CHLORO-6-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-BENZOIC ACID METHYL ESTER
CAS Number:
1980783-96-7
Molecular Formula:
C14H18BClO4
Molecular Weight:
296.5543
IUPAC Name:
methyl 2-chloro-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
InChI:
InChI=1S/C14H18BClO4/c1-13(2)14(3,4)20-15(19-13)9-7-6-8-10(16)11(9)12(17)18-5/h6-8H,1-5H3
InChI Key:
GUMXBRZEDJLNNF-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(Cl)cccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.099g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.554g/mol
Monoisotopic Mass:
296.099g/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.