| CAS Number | 87700-83-2 |
| Catalog Number | AG004JNB(AGN-PC-0WRAC3) |
| Chemical Name | N-Phenyl 4-bromonaphthamide |
| IUPAC Name | 4-bromo-N-phenylnaphthalene-1-carboxamide |
| InChI | InChI=1S/C17H12BrNO/c18-16-11-10-15(13-8-4-5-9-14(13)16)17(20)19-12-6-2-1-3-7-12/h1-11H,(H,19,20) |
| InChI Key | JYEXTBUDNDIBBS-UHFFFAOYSA-N |
| MDL Number | MFCD21609549 |
| Molecular Formula | C17H12BrNO |
| Molecular Weight | 326.1873 |
| SMILES | O=C(c1ccc(c2c1cccc2)Br)NC1CCCCC1 |
| Synonyms | N-Phenyl 4-bromonaphthamide,
87700-83-2,
4-Bromo-N-phenyl-1-naphthamide,
ACMC-20aizo,
C17H12BrNO,
ANW-75538,
MFCD21609549,
ZINC85476364,
TC-164283,
V8541,
B-8822,
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| Complexity | 340 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 325.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 326.193g/mol |
| Monoisotopic Mass | 325.01g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
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Certificate of Analysis
Lot Number