Name: Name:3-Chloro-5-methoxycarbonyl-phenyl-boronic acid pinacol ester
Brand: Angene
SKU: AG00CKY9
Rating: 90 (10 reviews)

3-Chloro-5-methoxycarbonyl-phenyl-boronic acid pinacol ester

CAS No.:

408492-29-5

Catalog Number:

AG00CKY9

Molecular Formula:

C14H18BClO4

Molecular Weight:

296.5543

Catalog Number:

AG00CKY9

Chemical Name:

3-Chloro-5-methoxycarbonyl-phenyl-boronic acid pinacol ester

CAS Number:

408492-29-5

Molecular Formula:

C14H18BClO4

Molecular Weight:

296.5543

MDL Number:

MFCD11846464

IUPAC Name:

methyl 3-chloro-5-(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)10-6-9(12(17)18-5)7-11(16)8-10/h6-8H,1-5H3

InChI Key:

OUPWIYDRPYRHNT-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(cc(c1)Cl)B1OC(C(O1)(C)C)(C)C

Complexity:

369

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

296.099g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

296.554g/mol

Monoisotopic Mass:

296.099g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: