2-Butene
PubChem CID: 62695
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| Compound Synonyms | trans-2-Butene, 2-BUTENE, 624-64-6, (E)-But-2-ene, Pseudobutylene, Butene-2, but-2-ene, beta-Butylene, trans-Butene, (E)-2-Butene, Butylene-2, trans-but-2-ene, 2-BUTENE, (E)-, 2-trans-Butene, beta-trans-Butylene, 107-01-7, Low-boiling butene-2, 2-Butene, (2E)-, trans-1,2-Dimethylethylene, (2E)-2-Butene, (2E)-but-2-ene, CH3CH=CHCH3, 017NGL487F, Dimethylethylene, beta-Butene, .beta.-Butylene, Butene, 2-, MFCD00064458, 2-Butene-trans, CCRIS 8971, HSDB 180, EINECS 203-452-9, BRN 1718755, UNII-017NGL487F, UNII-S1SK37516R, HSDB 5723, trans-But-2-en, 2-Buten, e-but-2-ene, EINECS 210-855-3, EINECS 273-307-2, 2-Butene, trans-, 2-Butene,(2E)-, 2-Butenes, cis & trans, E-2-BUTENE, E-.BETA.-BUTYLENE, EC 203-452-9, 2-BUTENE (E)-FORM, trans-2-Butene, >=99%, 3-01-00-00732 (Beilstein Handbook Reference), .BETA.-BUTYLENE, E-, TRANS-2-BUTENE [HSDB], DTXSID7027255, CHEBI:48363, CHEBI:48365, S1SK37516R, 2-BUTENE (E)-FORM [MI], AKOS025295555, (E)-2-C4H8, B0691, NS00007689, Q27121170 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Fatty alcohols, Hydrocarbons |
| Deep Smiles | C/C=C/C |
| Heavy Atom Count | 4.0 |
| Classyfire Class | Unsaturated hydrocarbons |
| Classyfire Subclass | Unsaturated aliphatic hydrocarbons |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 15.2 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (E)-but-2-ene |
| Veber Rule | True |
| Classyfire Superclass | Hydrocarbons |
| Xlogp | 2.3 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C4H8 |
| Inchi Key | IAQRGUVFOMOMEM-ONEGZZNKSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | but-2-ene |
| Esol Class | Very soluble |
| Functional Groups | C/C=C/C |
| Compound Name | 2-Butene |
| Exact Mass | 56.0626 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 56.0626 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 56.11 |
| Gi Absorption | False |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3+ |
| Smiles | C/C=C/C |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 1.0 |
| Egan Rule | True |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
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