| CAS Number | 857272-07-2 |
| Catalog Number | AG019WSE(AGN-PC-0WBV9N) |
| Chemical Name | 2-(3-Methoxypropoxy)aniline |
| IUPAC Name | 2-(3-methoxypropoxy)aniline |
| InChI | InChI=1S/C10H15NO2/c1-12-7-4-8-13-10-6-3-2-5-9(10)11/h2-3,5-6H,4,7-8,11H2,1H3 |
| InChI Key | LPTSBNWTHMKSEJ-UHFFFAOYSA-N |
| MDL Number | MFCD08688105 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| SMILES | COCCCOC1=C(N)C=CC=C1 |
| Synonyms | 2-(3-methoxypropoxy)aniline,
857272-07-2,
AC1Q4FUN,
SCHEMBL3066845,
2-(3-Methoxypropoxy)phenylamine,
CTK7B3164,
LPTSBNWTHMKSEJ-UHFFFAOYSA-N,
ZINC14629128,
AKOS008127769,
MCULE-9553250792,
NE23461,
TR-045987,
EN300-53013,
N/A,
|
| Complexity | 130 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 181.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 181.235g/mol |
| Monoisotopic Mass | 181.11g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number