(Z)-Hex-2-ene, 5-methyl-
PubChem CID: 5364850
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| Compound Synonyms | (Z)-Hex-2-ene, 5-methyl-, cis-5-Methyl-2-hexene, 13151-17-2, (Z)-5-methylhex-2-ene, (Z)-5-Methyl-2-hexene, POQ2TVS2I5, 5-Methyl-2-hexene, (2Z)-, 2-Hexene, 5-methyl-, (2Z)-, (Z)-(CH3)2CHCH2CH=CHCH3, (2Z)-5-Methyl-2-hexene, 2-Hexene, 5-methyl-, (Z)-, Z-5-methyl-2-hexene, 5-Methyl-2-hexene,cis, UNII-POQ2TVS2I5, 5-METHYL-CIS-2-HEXENE, GHBKCPRDHLITSE-PLNGDYQASA-N, AKOS006282301 |
|---|---|
| Topological Polar Surface Area | 0.0 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 7.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 51.1 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-5-methylhex-2-ene |
| Prediction Hob | 1.0 |
| Xlogp | 2.9 |
| Molecular Formula | C7H14 |
| Prediction Swissadme | 0.0 |
| Inchi Key | GHBKCPRDHLITSE-PLNGDYQASA-N |
| Fcsp3 | 0.7142857142857143 |
| Logs | -2.845 |
| Rotatable Bond Count | 2.0 |
| Logd | 3.596 |
| Compound Name | (Z)-Hex-2-ene, 5-methyl- |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 98.1096 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 98.1096 |
| Hydrogen Bond Acceptor Count | 0.0 |
| Molecular Weight | 98.19 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -2.1374717999999997 |
| Inchi | InChI=1S/C7H14/c1-4-5-6-7(2)3/h4-5,7H,6H2,1-3H3/b5-4- |
| Smiles | C/C=C\CC(C)C |
| Nring | 0.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Citrus Reticulata (Plant) Rel Props:Source_db:cmaup_ingredients - 2. Outgoing r'ship
FOUND_INto/from Citrus Unshiu (Plant) Rel Props:Source_db:cmaup_ingredients