| CAS Number | 1020962-38-2 |
| Catalog Number | AG01A8DM(AGN-PC-0WOBE6) |
| Chemical Name | N-(1-cyclopropylethyl)-4-methoxyaniline |
| IUPAC Name | N-(1-cyclopropylethyl)-4-methoxyaniline |
| InChI | InChI=1S/C12H17NO/c1-9(10-3-4-10)13-11-5-7-12(14-2)8-6-11/h5-10,13H,3-4H2,1-2H3 |
| InChI Key | RUKUPEYUUFJAQX-UHFFFAOYSA-N |
| MDL Number | MFCD11147338 |
| Molecular Formula | C12H17NO |
| Molecular Weight | 191.2695 |
| SMILES | COC1=CC=C(NC(C2CC2)C)C=C1 |
| Synonyms | N-(1-cyclopropylethyl)-4-methoxyaniline,
1020962-38-2,
AC1Q4DD5,
CTK7A4804,
AKOS000241607,
AKOS022483253,
MCULE-1978336909,
NE33473,
EN300-61377,
J3.569.615F,
N-(1-cyclopropylethyl)-N-(4-methoxyphenyl)amine,
Z1029460372,
alpha-Methyl-N-(4-methoxyphenyl)cyclopropane-1-methaneamine,
|
| Complexity | 171 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.274g/mol |
| Monoisotopic Mass | 191.131g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number