| CAS Number | 104338-87-6 |
| Catalog Number | AG01BXUG(AGN-PC-0JL3MJ) |
| Chemical Name | 3-Methoxy-4-propoxyaniline |
| IUPAC Name | 3-methoxy-4-propoxyaniline |
| InChI | InChI=1S/C10H15NO2/c1-3-6-13-9-5-4-8(11)7-10(9)12-2/h4-5,7H,3,6,11H2,1-2H3 |
| InChI Key | PBSDUCLSAXJGLA-UHFFFAOYSA-N |
| MDL Number | MFCD01674965 |
| Molecular Formula | C10H15NO2 |
| Molecular Weight | 181.2316 |
| SMILES | CCCOC1=C(OC)C=C(N)C=C1 |
| Synonyms | 3-methoxy-4-propoxyaniline,
4-Propoxy-m-anisidine,
m-ANISIDINE, 4-PROPOXY-,
104338-87-6,
M & B 5359,
BRN 2804920,
AC1L1S1H,
AC1Q578I,
SCHEMBL10187284,
DTXSID20146398,
ZINC1847085,
AKOS011388492,
LS-20196,
A1-05118,
CID59836,
C10-H15-N-O2,
|
| Complexity | 141 |
| 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 | 4 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number