| CAS Number | 54840-09-4 |
| Catalog Number | AG019UWA(AGN-PC-00PP3E) |
| Chemical Name | Methyl n-(4-hydroxyphenyl)carbamate |
| IUPAC Name | methyl N-(4-hydroxyphenyl)carbamate |
| InChI | InChI=1S/C8H9NO3/c1-12-8(11)9-6-2-4-7(10)5-3-6/h2-5,10H,1H3,(H,9,11) |
| InChI Key | OHNUXXRXJBCUFT-UHFFFAOYSA-N |
| MDL Number | MFCD00060228 |
| Molecular Formula | C8H9NO3 |
| Molecular Weight | 167.1620 |
| SMILES | O=C(OC)NC1=CC=C(O)C=C1 |
| Synonyms | METHYL N-(4-HYDROXYPHENYL)CARBAMATE,
54840-09-4,
methyl p-hydroxyphenylcarbamate,
SCHEMBL9089994,
CTK6J2914,
ZINC20212818,
AKOS009221454,
MCULE-5108765707,
NE11109,
4-Hydroxyphenylcarbamic acid methyl ester,
EN300-43021,
AB00999663-01,
Z444349998,
carbamate de methyle et de N(hydroxy-4 phenyle),
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 167.058g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 167.164g/mol |
| Monoisotopic Mass | 167.058g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number