| CAS Number | 919017-01-9 |
| Catalog Number | AG00GSTI(AGN-PC-0WNLAM) |
| Chemical Name | {3-[(oxolan-2-yl)methoxy]phenyl}methanamine |
| IUPAC Name | [3-(oxolan-2-ylmethoxy)phenyl]methanamine |
| InChI | InChI=1S/C12H17NO2/c13-8-10-3-1-4-11(7-10)15-9-12-5-2-6-14-12/h1,3-4,7,12H,2,5-6,8-9,13H2 |
| InChI Key | VQHVEECMNCLZGU-UHFFFAOYSA-N |
| MDL Number | MFCD08690186 |
| Molecular Formula | C12H17NO2 |
| Molecular Weight | 207.2689 |
| SMILES | NCC1=CC(OCC2OCCC2)=CC=C1 |
| Synonyms | 3-(TETRAHYDRO-FURAN-2-YLMETHOXY)-BENZYLAMINE,
919017-01-9,
[3-(oxolan-2-ylmethoxy)phenyl]methanamine,
EN300-44842,
AC1Q53WN,
CTK7E5801,
3210AF,
SBB085459,
AKOS000130641,
AKOS016344018,
MCULE-3206470205,
[3-(oxolan-2-ylmethoxy)phenyl]methylamine,
TR-056735,
BB 0254501,
3-(tetrahydro-furan-2-ylmethoxy)-benzylamine, AldrichCPR,
C12H17NO2,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 207.273g/mol |
| Monoisotopic Mass | 207.126g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 44.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number