| CAS Number | 1750-08-9 |
| Catalog Number | AG019X4Q |
| Chemical Name | 2-(3-Aminopropoxy)-1,3-dimethylbenzene hydrochloride |
| IUPAC Name | 3-(2,6-dimethylphenoxy)propan-1-amine;hydrochloride |
| InChI | InChI=1S/C11H17NO.ClH/c1-9-5-3-6-10(2)11(9)13-8-4-7-12;/h3,5-6H,4,7-8,12H2,1-2H3;1H |
| InChI Key | FBCPDXMKPKFFCL-UHFFFAOYSA-N |
| MDL Number | MFCD13195991 |
| Molecular Formula | C11H18ClNO |
| Molecular Weight | 215.7197 |
| SMILES | Cl.CC1=C(OCCCN)C(C)=CC=C1 |
| Synonyms | 2-(3-aminopropoxy)-1,3-dimethylbenzene hydrochloride,
1750-08-9,
3-(2,6-dimethylphenoxy)propan-1-amine hydrochloride,
AC1Q39H5,
CTK7E8481,
AKOS008099078,
MCULE-8283214713,
NE42868,
EN300-54041,
Z815264262,
|
| Complexity | 128 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 215.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 215.721g/mol |
| Monoisotopic Mass | 215.108g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number