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887358-45-4 | N-(4-AMINOPHENYL)-5-METHYL-3-FURAMIDE
CAS No: 887358-45-4 Catalog No: AG004479 MDL No:MFCD00448335
Product Description
Catalog Number:
AG004479
Chemical Name:
N-(4-AMINOPHENYL)-5-METHYL-3-FURAMIDE
CAS Number:
887358-45-4
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD00448335
IUPAC Name:
N-(4-aminophenyl)-5-methylfuran-3-carboxamide
InChI:
InChI=1S/C12H12N2O2/c1-8-6-9(7-16-8)12(15)14-11-4-2-10(13)3-5-11/h2-7H,13H2,1H3,(H,14,15)
InChI Key:
GUTHXYNNQOQQPP-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)NC(=O)c1coc(c1)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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