methyl 4-(2-benzylbenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate


Chemical Name: methyl 4-(2-benzylbenzoyl)-2,5-dimethyl-1H-pyrrole-3-carboxylate
CAS Number: 120934-96-5
Product Number: AG007PCU(AGN-PC-0JK6JG)
Synonyms:
MDL No: MFCD00274043
Molecular Formula: C22H21NO3
Molecular Weight: 347.4070

Identification/Properties


Computed Properties
Molecular Weight:
347.414g/mol
XLogP3:
4.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
347.152g/mol
Monoisotopic Mass:
347.152g/mol
Topological Polar Surface Area:
59.2A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
500
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


Request for Quotation


Customer Feedback