| CAS Number | 914202-90-7 |
| Catalog Number | AG01A8NF(AGN-PC-0WOAQ1) |
| Chemical Name | [1-(2-methoxyphenyl)pyrrolidin-3-yl]methanamine |
| IUPAC Name | [1-(2-methoxyphenyl)pyrrolidin-3-yl]methanamine |
| InChI | InChI=1S/C12H18N2O/c1-15-12-5-3-2-4-11(12)14-7-6-10(8-13)9-14/h2-5,10H,6-9,13H2,1H3 |
| InChI Key | CVGYDKVFXXSBNS-UHFFFAOYSA-N |
| MDL Number | MFCD09759251 |
| Molecular Formula | C12H18N2O |
| Molecular Weight | 206.2841 |
| SMILES | COC1=C(N2CC(CN)CC2)C=CC=C1 |
| Synonyms | [1-(2-methoxyphenyl)pyrrolidin-3-yl]methanamine,
914202-90-7,
1-[1-(2-methoxyphenyl)pyrrolidin-3-yl]methanamine,
AC1Q459Y,
BBL021741,
MFCD09759251,
STK894458,
AKOS000173055,
AKOS016346970,
MCULE-3589081171,
NE25071,
EN300-62089,
Z1222285094,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.142g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.289g/mol |
| Monoisotopic Mass | 206.142g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 38.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number