| CAS Number | 1353853-58-3 |
| Catalog Number | AG01AM96 |
| Chemical Name | 4-(Oxolan-3-Yl)Aniline |
| IUPAC Name | 4-(oxolan-3-yl)aniline |
| InChI | InChI=1S/C10H13NO/c11-10-3-1-8(2-4-10)9-5-6-12-7-9/h1-4,9H,5-7,11H2 |
| InChI Key | RJTIOFHVFUMIAD-UHFFFAOYSA-N |
| MDL Number | MFCD21099832 |
| Molecular Formula | C10H13NO |
| Molecular Weight | 163.2163 |
| SMILES | NC1=CC=C(C2COCC2)C=C1 |
| Synonyms | 4-(oxolan-3-yl)aniline,
1353853-58-3,
AKOS015946528,
Z2216302968,
|
| Complexity | 141 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 163.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 163.22g/mol |
| Monoisotopic Mass | 163.1g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number