| CAS Number | 169556-13-2 |
| Catalog Number | AG007UVB(AGN-PC-0MY1JX) |
| Chemical Name | 4-[methyl(phenyl)amino]butan-1-ol |
| IUPAC Name | 4-(N-methylanilino)butan-1-ol |
| InChI | InChI=1S/C11H17NO/c1-12(9-5-6-10-13)11-7-3-2-4-8-11/h2-4,7-8,13H,5-6,9-10H2,1H3 |
| InChI Key | KSIAUYAABCITOE-UHFFFAOYSA-N |
| MDL Number | MFCD08691726 |
| Molecular Formula | C11H17NO |
| Molecular Weight | 179.2588 |
| SMILES | N(C)(CCCCO)C1C=CC=CC=1 |
| Synonyms | 169556-13-2,
1-Butanol, 4-(methylphenylamino)-,
4-[methyl(phenyl)amino]butan-1-ol,
4-(Methyl(phenyl)amino)butan-1-ol,
SCHEMBL9755649,
CTK0E5011,
DTXSID20434843,
N-4-Hydroxybutyl-N-methylaniline,
KSIAUYAABCITOE-UHFFFAOYSA-N,
CHEMBRDG-BB 4024933,
ZX-CM005522,
4-[Methyl(phenyl)amino]-1-butanol,
MFCD08691726,
ZINC19091354,
AKOS005302375,
AJ-71589,
Y-4392,
4-(methyl-phenyl-amino)butan-1-ol,
CID10058105,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 179.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 179.263g/mol |
| Monoisotopic Mass | 179.131g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 23.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number