| CAS Number | 938459-02-0 |
| Catalog Number | AG006CQ9(AGN-PC-0WB3HJ) |
| Chemical Name | 2-(1-Isobutylpiperidin-2-yl)ethanamine |
| IUPAC Name | 2-[1-(2-methylpropyl)piperidin-2-yl]ethanamine |
| InChI | InChI=1S/C11H24N2/c1-10(2)9-13-8-4-3-5-11(13)6-7-12/h10-11H,3-9,12H2,1-2H3 |
| InChI Key | FQDBLXOMWPGHEF-UHFFFAOYSA-N |
| MDL Number | MFCD09055295 |
| Molecular Formula | C11H24N2 |
| Molecular Weight | 184.3217 |
| SMILES | C(C(C)C)N1C(CCCC1)CCN |
| Synonyms | 2-(1-ISOBUTYLPIPERIDIN-2-YL)ETHANAMINE,
938459-02-0,
SCHEMBL8234850,
CTK5H3510,
DTXSID70672399,
MFCD09055295,
AKOS013073096,
2-(1-Isobutyl-2-piperidinyl)ethanamine,
Y-5121,
2-(1-Isobutylpiperidin-2-yl)ethanamine, AldrichCPR,
2-[1-(2-Methylpropyl)piperidin-2-yl]ethan-1-amine,
2- ETHANAMINE,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.327g/mol |
| Monoisotopic Mass | 184.194g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
|
H302
|
|
Packing Group
|
\N
|
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Precautionary statements
|
P280-P305+P351+P338
|
|
UN Code
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\N
|
Certificate of Analysis
Lot Number