| CAS Number | 21722-08-7 |
| Catalog Number | AG00I47W(AGN-PC-0WNROG) |
| Chemical Name | 1-Phenyl-1H-imidazol-2-amine |
| IUPAC Name | 1-phenylimidazol-2-amine |
| InChI | InChI=1S/C9H9N3/c10-9-11-6-7-12(9)8-4-2-1-3-5-8/h1-7H,(H2,10,11) |
| InChI Key | ACOLGRUIHSRLDA-UHFFFAOYSA-N |
| MDL Number | MFCD20690925 |
| Molecular Formula | C9H9N3 |
| Molecular Weight | 159.1879 |
| SMILES | NC1N(C2=CC=CC=C2)C=CN=1 |
| Synonyms | 1-Phenyl-1H-imidazol-2-amine,
21722-08-7,
1-phenyl-1H-imidazol-2-ylamine,
SCHEMBL1407881,
SCHEMBL11472166,
ZINC34160006,
AKOS022187477,
KS-8570,
MCULE-8136898510,
NE34982,
FT-0764821,
Z1834265811,
|
| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.192g/mol |
| Monoisotopic Mass | 159.08g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H319
|
|
Packing Group
|
|
|
Precautionary statements
|
P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number