| CAS Number | 844873-52-5 |
| Catalog Number | AG019LGF(AGN-PC-04PA1K) |
| Chemical Name | 3-(Cyclopentyloxy)-4-methoxyaniline hydrochloride |
| IUPAC Name | 3-cyclopentyloxy-4-methoxyaniline;hydrochloride |
| InChI | InChI=1S/C12H17NO2.ClH/c1-14-11-7-6-9(13)8-12(11)15-10-4-2-3-5-10;/h6-8,10H,2-5,13H2,1H3;1H |
| InChI Key | NTNFFTNYYSBKSN-UHFFFAOYSA-N |
| MDL Number | MFCD09971414 |
| Molecular Formula | C12H18ClNO2 |
| Molecular Weight | 243.7298 |
| SMILES | Cl.COC1=C(OC2CCCC2)C=C(N)C=C1 |
| Synonyms | 3-(cyclopentyloxy)-4-methoxyaniline hydrochloride,
844873-52-5,
AC1Q3C0O,
CTK7A7344,
MCULE-9699583254,
NE48944,
EN300-31180,
Z324553016,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.731g/mol |
| Monoisotopic Mass | 243.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number