| CAS Number | 887358-45-4 |
| Catalog Number | AG004479(AGN-PC-0WB4EK) |
| Chemical Name | N-(4-aminophenyl)-5-methyl-3-furamide |
| 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 |
| MDL Number | MFCD00448335 |
| Molecular Formula | C12H12N2O2 |
| Molecular Weight | 216.2359 |
| SMILES | C1(=COC(C)=C1)C(=O)NC1=CC=C(C=C1)N |
| Synonyms | N-(4-AMINOPHENYL)-5-METHYL-3-FURAMIDE,
887358-45-4,
N-(4-aminophenyl)-5-methylfuran-3-carboxamide,
N-(4-aminophenyl)(5-methyl(3-furyl))carboxamide,
CTK5G1321,
DTXSID20589564,
ALBB-023459,
ZX-AN021973,
ZX-CM016290,
MFCD00448335,
SBB071613,
ZINC19093821,
AKOS003240831,
MCULE-8458536599,
AJ-72239,
ST085810,
BC4526282,
W-6901,
3-furancarboxamide, N-(4-aminophenyl)-5-methyl-,
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| 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 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number