| CAS Number | 1240526-99-1 |
| Catalog Number | AG01A98V(AGN-PC-0WO9E3) |
| Chemical Name | 4-phenyl-1H-imidazole-1,5-diamine |
| IUPAC Name | 4-phenylimidazole-1,5-diamine |
| InChI | InChI=1S/C9H10N4/c10-9-8(12-6-13(9)11)7-4-2-1-3-5-7/h1-6H,10-11H2 |
| InChI Key | TWDBUHTUNHGSRG-UHFFFAOYSA-N |
| MDL Number | MFCD16547682 |
| Molecular Formula | C9H10N4 |
| Molecular Weight | 174.2025 |
| SMILES | NC1N(N)C=NC=1C1=CC=CC=C1 |
| Synonyms | 4-phenyl-1H-imidazole-1,5-diamine,
1240526-99-1,
AC1Q54Q9,
ZINC47844220,
AKOS005260380,
NE48810,
EN300-64479,
|
| Complexity | 167 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 174.091g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 174.207g/mol |
| Monoisotopic Mass | 174.091g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 69.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number