| CAS Number | 916766-86-4 |
| Catalog Number | AG006R9V(AGN-PC-0WOWVI) |
| Chemical Name | N-Methyl(3-methyl-2-furyl)methylamine |
| IUPAC Name | N-methyl-1-(3-methylfuran-2-yl)methanamine |
| InChI | InChI=1S/C7H11NO/c1-6-3-4-9-7(6)5-8-2/h3-4,8H,5H2,1-2H3 |
| InChI Key | KBNPUPCSMGGUHM-UHFFFAOYSA-N |
| MDL Number | MFCD09879907 |
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.1683 |
| SMILES | CNCC1=C(C)C=CO1 |
| Synonyms | 916766-86-4,
N-METHYL(3-METHYL-2-FURYL)METHYLAMINE,
N-Methyl(3-methylfur-2-yl)methylamine,
methyl[(3-methylfuran-2-yl)methyl]amine,
N-methyl-1-(3-methylfuran-2-yl)methanamine,
2-Furanmethanamine, N,3-dimethyl-,
CTK5H0307,
DTXSID00640263,
MFCD09879907,
SBB085607,
ZINC12370520,
AKOS009345088,
3-Methyl-2-[(methylamino)methyl]furan,
methyl[(3-methyl(2-furyl))methyl]amine,
DB-079127,
RT-014459,
FT-0716628,
F2148-2243,
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| Complexity | 85 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.171g/mol |
| Monoisotopic Mass | 125.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 25.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number