| CAS Number | 289718-11-2 |
| Catalog Number | AG01AB7G(AGN-PC-0L0VWM) |
| Chemical Name | [2-(4-Methylphenoxy)phenyl]methanamine |
| IUPAC Name | [2-(4-methylphenoxy)phenyl]methanamine |
| InChI | InChI=1S/C14H15NO/c1-11-6-8-13(9-7-11)16-14-5-3-2-4-12(14)10-15/h2-9H,10,15H2,1H3 |
| InChI Key | PPOVZAQWWRVUAE-UHFFFAOYSA-N |
| MDL Number | MFCD07365250 |
| Molecular Formula | C14H15NO |
| Molecular Weight | 213.2750 |
| SMILES | CC1=CC=C(OC2=C(CN)C=CC=C2)C=C1 |
| Synonyms | [2-(4-methylphenoxy)phenyl]methanamine,
289718-11-2,
AC1MZAQ3,
AC1Q2MQG,
SCHEMBL3288360,
CTK7E6409,
ZINC2513066,
AKOS000261356,
MCULE-8620467674,
NE29820,
EN300-70688,
1-[2-(4-METHYLPHENOXY)PHENYL]METHANAMINE,
A1-05247,
Z1263811712,
CID3845078,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 213.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 213.28g/mol |
| Monoisotopic Mass | 213.115g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number