| CAS Number | 847837-50-7 |
| Catalog Number | AG019OFX |
| Chemical Name | 1-(4-butylphenyl)-2-methylpropan-1-amine |
| IUPAC Name | 1-(4-butylphenyl)-2-methylpropan-1-amine |
| InChI | InChI=1S/C14H23N/c1-4-5-6-12-7-9-13(10-8-12)14(15)11(2)3/h7-11,14H,4-6,15H2,1-3H3 |
| InChI Key | INGQSKTZWKTZJE-UHFFFAOYSA-N |
| MDL Number | MFCD07325242 |
| Molecular Formula | C14H23N |
| Molecular Weight | 205.3391 |
| SMILES | CCCCC1=CC=C(C(C(C)C)N)C=C1 |
| Synonyms | 1-(4-butylphenyl)-2-methylpropan-1-amine,
847837-50-7,
AC1NLR0N,
AC1Q2VED,
CTK6D6360,
AKOS000250276,
AKOS017276352,
MCULE-8154521113,
NE13527,
EN300-13870,
Z94602047,
CID4962700,
1-(4-butylphenyl)-2-methyl-propan-1-amine,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.183g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 205.345g/mol |
| Monoisotopic Mass | 205.183g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number