| CAS Number | 6337-84-4 |
| Catalog Number | AG019WDA |
| Chemical Name | 4-[(phenylamino)methyl]phenol hydrochloride |
| IUPAC Name | 4-(anilinomethyl)phenol;hydrochloride |
| InChI | InChI=1S/C13H13NO.ClH/c15-13-8-6-11(7-9-13)10-14-12-4-2-1-3-5-12;/h1-9,14-15H,10H2;1H |
| InChI Key | NYCYUCZUPKBQHE-UHFFFAOYSA-N |
| MDL Number | MFCD12912981 |
| Molecular Formula | C13H14ClNO |
| Molecular Weight | 235.7094 |
| NSC Number | 37576 |
| SMILES | Cl.OC1=CC=C(CNC2=CC=CC=C2)C=C1 |
| Synonyms | 4-[(phenylamino)methyl]phenol hydrochloride,
6337-84-4,
AC1Q3F5Q,
CTK7J9345,
NSC37576,
NSC-37576,
MCULE-2083115659,
NE15625,
EN300-51540,
4-[(phenylamino)methyl]phenol hydrochloride, AldrichCPR,
4-((phenylamino)methyl)phenol hydrochloride,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.076g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.711g/mol |
| Monoisotopic Mass | 235.076g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number