| CAS Number | 115344-19-9 |
| Catalog Number | AG01AKEB(AGN-PC-0NL6DY) |
| Chemical Name | 3-[(2-Methylpropyl)amino]phenol |
| IUPAC Name | 3-(2-methylpropylamino)phenol |
| InChI | InChI=1S/C10H15NO/c1-8(2)7-11-9-4-3-5-10(12)6-9/h3-6,8,11-12H,7H2,1-2H3 |
| InChI Key | MQFIBILAYLDHAP-UHFFFAOYSA-N |
| MDL Number | MFCD09744928 |
| Molecular Formula | C10H15NO |
| Molecular Weight | 165.2322 |
| SMILES | CC(CNC1=CC(O)=CC=C1)C |
| Synonyms | 3-[(2-methylpropyl)amino]phenol,
115344-19-9,
3-(ISOBUTYLAMINO)PHENOL,
SCHEMBL8077402,
ZINC20193220,
AKOS009201011,
MCULE-6170200418,
NE37405,
SC-40963,
EN300-83861,
Z1251171292,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.236g/mol |
| Monoisotopic Mass | 165.115g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number