4-Chloro-2-isopropoxyphenylboronic acid


Chemical Name: 4-Chloro-2-isopropoxyphenylboronic acid
CAS Number: 1256355-04-0
Product Number: AG000O2Q(AGN-PC-0WAA82)
Synonyms:
MDL No:
Molecular Formula: C9H12BClO3
Molecular Weight: 214.4538

Identification/Properties


Computed Properties
Molecular Weight:
214.452g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
214.057g/mol
Monoisotopic Mass:
214.057g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
177
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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