4-(Propylaminocarbonyl)benzeneboronic acid


Chemical Name: 4-(Propylaminocarbonyl)benzeneboronic acid
CAS Number: 171922-46-6
Product Number: AG00APVV(AGN-PC-0KKVJ4)
Synonyms:
MDL No:
Molecular Formula: C10H14BNO3
Molecular Weight: 207.0341

Identification/Properties


Computed Properties
Molecular Weight:
207.036g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
207.107g/mol
Monoisotopic Mass:
207.107g/mol
Topological Polar Surface Area:
69.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
203
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#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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