| CAS Number | 938459-01-9 |
| Catalog Number | AG00GVPJ(AGN-PC-0WAKSO) |
| Chemical Name | 3-(Azepan-1-yl)-N-methylpropan-1-amine |
| IUPAC Name | 3-(azepan-1-yl)-N-methylpropan-1-amine |
| InChI | InChI=1S/C10H22N2/c1-11-7-6-10-12-8-4-2-3-5-9-12/h11H,2-10H2,1H3 |
| InChI Key | URPNAVAVDRFKOZ-UHFFFAOYSA-N |
| MDL Number | MFCD09055282 |
| Molecular Formula | C10H22N2 |
| Molecular Weight | 170.2951 |
| SMILES | CNCCCN1CCCCCC1 |
| Synonyms | 938459-01-9,
N-[3-(1-AZEPANYL)PROPYL]-N-METHYLAMINE,
3-(Azepan-1-yl)-N-methylpropan-1-amine,
(3-AZEPAN-1-YLPROPYL)METHYLAMINE,
SCHEMBL2356698,
CTK5H3509,
DTXSID40609031,
URPNAVAVDRFKOZ-UHFFFAOYSA-N,
3756AF,
MFCD09055282,
ZINC19089119,
AKOS005289735,
RTR-050222,
[3-(azepan-1-yl)propyl](methyl)amine,
3-(1-Azepanyl)-N-methyl-1-propanamine,
AJ-71125,
TR-050222,
Y-5108,
N-[3-(1-Azepanyl)propyl]-N-methylamine, AldrichCPR,
C10H22N2,
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| Complexity | 96 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 170.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 170.3g/mol |
| Monoisotopic Mass | 170.178g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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