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Home > Nitro Compounds > 477872-02-9
477872-02-9 | N-(2-methoxy-4-nitrophenyl)-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide
CAS No: 477872-02-9 Catalog No: AG00IOK0 MDL No:MFCD02102456
Product Description
Catalog Number:
AG00IOK0
Chemical Name:
N-(2-methoxy-4-nitrophenyl)-2-(1-methyl-1H-pyrrol-2-yl)-2-oxoacetamide
CAS Number:
477872-02-9
Molecular Formula:
C14H13N3O5
Molecular Weight:
303.2701
MDL Number:
MFCD02102456
IUPAC Name:
N-(2-methoxy-4-nitrophenyl)-2-(1-methylpyrrol-2-yl)-2-oxoacetamide
InChI:
InChI=1S/C14H13N3O5/c1-16-7-3-4-11(16)13(18)14(19)15-10-6-5-9(17(20)21)8-12(10)22-2/h3-8H,1-2H3,(H,15,19)
InChI Key:
KFGJLTZNBONMEV-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1NC(=O)C(=O)c1cccn1C)[N+](=O)[O-]
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.086g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
303.274g/mol
Monoisotopic Mass:
303.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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