difluoro(methyl 3-{5-[(3,5-dimethyl-2H-pyrrol-2-ylidene-kappaN)methyl]-1H-pyrrol-2-yl-kappaN} propanoatato)boronic acid


Chemical Name: difluoro(methyl 3-{5-[(3,5-dimethyl-2H-pyrrol-2-ylidene-kappaN)methyl]-1H-pyrrol-2-yl-kappaN} propanoatato)boronic acid
CAS Number: 1242057-00-6
Product Number: AG000LN9(AGN-PC-0WAJBZ)
Synonyms:
MDL No:
Molecular Formula:
Molecular Weight:

Identification/Properties


Computed Properties
Molecular Weight:
306.12g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
306.135g/mol
Monoisotopic Mass:
306.135g/mol
Topological Polar Surface Area:
34.2A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
600
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


NMR Spectrum


Other Analytical Data


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