1-Butene
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CAS Number 106-98-9
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Catalog Number io-1867
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Classification Hydrocarbons
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Molecular Weight 56.1100
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SMILES CCC=C
| Size | QTY | Notes | |
|---|---|---|---|
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But-1-ene is a butene with unsaturation at position 1.
| 1 | 1-BUTENE |
| 2 | But-1-ene |
| 3 | Ethylethylene |
| 4 | BUTENE |
| 5 | 1-Butylene |
| Molecular Formula | C4H8 |
|---|---|
| Canonical SMILES | CCC=C |
| Isomeric SMILES | CCC=C |
| Molecular Weight | 56.1100 |
| InChIKey | VXNZUUAINFGPBY-UHFFFAOYSA-N |
| InChI | InChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3 |
| XLogP | 2.4000 |
| ExactMass | 56.0626 |
| MonoisotopicMass | 56.0626 |
| TPSA | 0.0000 |
| Complexity | 14.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 0 |
| RotatableBondCount | 1 |
| HeavyAtomCount | 4 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 109371 |
| PatentFamilyCount | 41336 |
| LiteratureCount | 6082 |
