| CAS Number | 313345-08-3 |
| Catalog Number | AG00COUV(AGN-PC-0WNOEN) |
| Chemical Name | [1-(2-Amino-ethyl)-piperidin-4-yl]-dimethyl-amine |
| IUPAC Name | 1-(2-aminoethyl)-N,N-dimethylpiperidin-4-amine |
| InChI | InChI=1S/C9H21N3/c1-11(2)9-3-6-12(7-4-9)8-5-10/h9H,3-8,10H2,1-2H3 |
| InChI Key | XYIUIYHRNFXKQF-UHFFFAOYSA-N |
| MDL Number | MFCD12143426 |
| Molecular Formula | C9H21N3 |
| Molecular Weight | 171.2831 |
| SMILES | CN(C1CCN(CCN)CC1)C |
| Synonyms | 313345-08-3,
[1-(2-Amino-ethyl)-piperidin-4-yl]-dimethyl-amine,
1-(2-aminoethyl)-N,N-dimethylpiperidin-4-amine,
1-Piperidineethanamine, 4-(dimethylamino)-,
SCHEMBL1306996,
ZINC36191296,
AKOS009602102,
MCULE-9683040615,
NE17567,
AM100655,
4-?(Dimethylamino)?-1-?piperidineethanamine,
[1-(2-aminoethyl)piperidin-4-yl]-dimethylamine,
[1-(2-Amino-ethyl)-piperidin-4-yl]dimethyl-amine,
Z1335657405,
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| Complexity | 117 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 171.174g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 171.288g/mol |
| Monoisotopic Mass | 171.174g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number