| CAS Number | 1048640-73-8 |
| Catalog Number | AG00J3T7 |
| Chemical Name | (2-Methylbenzyl)(tetrahydro-2-furanylmethyl)amine hydrochloride |
| IUPAC Name | N-[(2-methylphenyl)methyl]-1-(oxolan-2-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C13H19NO.ClH/c1-11-5-2-3-6-12(11)9-14-10-13-7-4-8-15-13;/h2-3,5-6,13-14H,4,7-10H2,1H3;1H |
| InChI Key | YXUZFLMURRWMKF-UHFFFAOYSA-N |
| MDL Number | MFCD19442585 |
| Molecular Formula | C13H20ClNO |
| Molecular Weight | 241.757 |
| SMILES | O1CCCC1CNCC1C=CC=CC=1C.Cl |
| Synonyms | (2-Methylbenzyl)(tetrahydro-2-furanylmethyl)amine hydrochloride,
1048640-73-8,
ARONIS005007,
KS-00003XN9,
ZX-CM016859,
MFCD03930956,
AKOS003745328,
MCULE-8511433771,
ST45041788,
[(2-methylphenyl)methyl](oxolan-2-ylmethyl)amine, chloride,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.123g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.759g/mol |
| Monoisotopic Mass | 241.123g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number