Benzoic acid, 4-(1,3,2-dioxaborinan-2-yl)-


Chemical Name: Benzoic acid, 4-(1,3,2-dioxaborinan-2-yl)-
CAS Number: 126747-13-5
Product Number: AG000T6F(AGN-PC-001PDD)
Synonyms:
MDL No:
Molecular Formula: C10H11BO4
Molecular Weight: 206.0029

Identification/Properties


Computed Properties
Molecular Weight:
206.004g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
206.075g/mol
Monoisotopic Mass:
206.075g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
220
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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