| CAS Number | 858796-53-9 |
| Catalog Number | AG019VT1(AGN-PC-0WNLKG) |
| Chemical Name | N-((5-Methylfuran-2-yl)methyl)propan-2-amine hydrochloride |
| IUPAC Name | N-[(5-methylfuran-2-yl)methyl]propan-2-amine;hydrochloride |
| InChI | InChI=1S/C9H15NO.ClH/c1-7(2)10-6-9-5-4-8(3)11-9;/h4-5,7,10H,6H2,1-3H3;1H |
| InChI Key | BHHWPGHSOGFGDR-UHFFFAOYSA-N |
| MDL Number | MFCD12197240 |
| Molecular Formula | C9H16ClNO |
| Molecular Weight | 189.6824 |
| SMILES | Cl.CC(NCC1OC(C)=CC=1)C |
| Synonyms | 858796-53-9,
[(5-methylfuran-2-yl)methyl](propan-2-yl)amine hydrochloride,
N-[(5-methyl-2-furyl)methyl]propan-2-amine hydrochloride,
N-[(5-Methyl-2-furyl)methyl]propan-2-aminehydrochloride,
N-((5-Methylfuran-2-yl)methyl)propan-2-amine hydrochloride,
AC1Q394E,
KS-00001LAL,
0886AF,
MFCD12197240,
AKOS026741989,
MCULE-8235691085,
EN300-49099,
isopropyl[(5-methylfuran-2-yl)methyl]amine hydrochloride,
Z600428342,
C9H16ClNO,
130539-95-6,
|
| Complexity | 114 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.683g/mol |
| Monoisotopic Mass | 189.092g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 25.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number