| CAS Number | 101097-65-8 |
| Catalog Number | AG019VDT(AGN-PC-0NBY8S) |
| Chemical Name | methyl 4-[(phenoxycarbonyl)amino]benzoate |
| IUPAC Name | methyl 4-(phenoxycarbonylamino)benzoate |
| InChI | InChI=1S/C15H13NO4/c1-19-14(17)11-7-9-12(10-8-11)16-15(18)20-13-5-3-2-4-6-13/h2-10H,1H3,(H,16,18) |
| InChI Key | FNZKLMFKBJUXJW-UHFFFAOYSA-N |
| MDL Number | MFCD00587515 |
| Molecular Formula | C15H13NO4 |
| Molecular Weight | 271.2680 |
| SMILES | COC(C1=CC=C(NC(OC2=CC=CC=C2)=O)C=C1)=O |
| Synonyms | methyl 4-[(phenoxycarbonyl)amino]benzoate,
101097-65-8,
AC1Q43G3,
SCHEMBL2197321,
CTK6J0044,
FNZKLMFKBJUXJW-UHFFFAOYSA-N,
ZINC35151999,
AKOS003665392,
MCULE-4249497876,
NE34036,
EN300-44980,
[4-(Methoxycarbonyl)phenyl]carbamic acid phenyl ester,
Methyl 4-(phenoxycarbonylamino)benzoate,
CID10869391,
|
| Complexity | 331 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 271.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.272g/mol |
| Monoisotopic Mass | 271.084g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number