| CAS Number | 13024-16-3 |
| Catalog Number | AG009IQG(AGN-PC-02U781) |
| Chemical Name | 2-Methyl-4-phenoxyaniline |
| IUPAC Name | 2-methyl-4-phenoxyaniline |
| InChI | InChI=1S/C13H13NO/c1-10-9-12(7-8-13(10)14)15-11-5-3-2-4-6-11/h2-9H,14H2,1H3 |
| InChI Key | LOXZCYZBCSAIIF-UHFFFAOYSA-N |
| MDL Number | MFCD08688317 |
| Molecular Formula | C13H13NO |
| Molecular Weight | 199.2484 |
| SMILES | CC1=C(N)C=CC(=C1)OC1=CC=CC=C1 |
| Synonyms | 2-methyl-4-phenoxyaniline,
13024-16-3,
AC1Q2FKP,
SCHEMBL9297973,
CTK7D8068,
Benzenamine, 2-methyl-4-phenoxy-,
3571AD,
MFCD08688317,
ZINC14630803,
AKOS008130416,
AS-8758,
MCULE-8486005743,
NE57976,
AJ-65115,
TR-046973,
BB 0216594,
EN300-73410,
C13H13NO,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.253g/mol |
| Monoisotopic Mass | 199.1g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number