| CAS Number | 919017-03-1 |
| Catalog Number | AG00J84S(AGN-PC-0WC7ZF) |
| Chemical Name | 1-[3-Methoxy-4-(tetrahydrofuran-2-ylmethoxy)phenyl]methanamine |
| IUPAC Name | [3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methanamine |
| InChI | InChI=1S/C13H19NO3/c1-15-13-7-10(8-14)4-5-12(13)17-9-11-3-2-6-16-11/h4-5,7,11H,2-3,6,8-9,14H2,1H3 |
| InChI Key | ZSKDHYZLZGYADN-UHFFFAOYSA-N |
| MDL Number | MFCD09040094 |
| Molecular Formula | C13H19NO3 |
| Molecular Weight | 237.2949 |
| SMILES | COC1=C(OCC2OCCC2)C=CC(CN)=C1 |
| Synonyms | 919017-03-1,
[3-methoxy-4-(tetrahydrofuran-2-ylmethoxy)benzyl]amine,
1-[3-methoxy-4-(tetrahydrofuran-2-ylmethoxy)phenyl]methanamine,
[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methanamine,
(3-Methoxy-4-((tetrahydrofuran-2-yl)methoxy)phenyl)methanamine,
CTK6J7984,
AC1Q4796,
ALBB-027137,
MFCD09040094,
SBB085448,
AKOS000128961,
AKOS017259029,
MCULE-8664503336,
EN300-40473,
[3-methoxy-4-(oxolan-2-ylmethoxy)phenyl]methylamine,
3-Methoxy-4-(tetrahydro-furan-2-ylmethoxy)-benzylamine,
T0483,
|
| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.299g/mol |
| Monoisotopic Mass | 237.136g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 53.7A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number