sec-Butylamine
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CAS Number 513-49-5
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Catalog Number io-1884
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Classification Amines
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Molecular Weight 73.1400
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SMILES CCC(C)N
| Size | QTY | Notes | |
|---|---|---|---|
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| 1 | (S)-(+)-2-Aminobutane |
| 2 | (2S)-butan-2-amine |
| 3 | (S)-(+)-sec-Butylamine |
| 4 | 2-Butanamine, (2S)- |
| 5 | (S)-sec-Butylamine |
| Molecular Formula | C4H11N |
|---|---|
| Canonical SMILES | CCC(C)N |
| Isomeric SMILES | CC[C@H](C)N |
| Molecular Weight | 73.1400 |
| InChIKey | BHRZNVHARXXAHW-BYPYZUCNSA-N |
| InChI | InChI=1S/C4H11N/c1-3-4(2)5/h4H,3,5H2,1-2H3/t4-/m0/s1 |
| XLogP | 0.6000 |
| ExactMass | 73.0891 |
| MonoisotopicMass | 73.0891 |
| TPSA | 26.0000 |
| Complexity | 19.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 1 |
| HBondAcceptorCount | 1 |
| RotatableBondCount | 1 |
| HeavyAtomCount | 5 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 1 |
| DefinedAtomStereoCount | 1 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 652 |
| PatentFamilyCount | 171 |
| LiteratureCount | 26 |
