2-Hexen-1-ol, (2Z)-
PubChem CID: 5324489
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | cis-2-Hexen-1-ol, 928-94-9, (Z)-hex-2-en-1-ol, cis-Hex-2-en-1-ol, 2-Hexen-1-ol, (Z)-, (Z)-2-Hexen-1-ol, 2-Hexen-1-ol, (2Z)-, 2Z-Hexen-1-ol, (2Z)-2-Hexen-1-ol, (Z)-2-hexenol, 871TEL510E, 2-Hexen-1-ol, cis-, EINECS 213-190-7, MFCD00063209, AI3-34791, FEMA NO. 3924, DTXSID20883610, FEMA NO. 2562, Z-, (Z)-2-HEXEN-1-OL [FHFI], UNII-871TEL510E, cis-2-hexenol, Z-2-hexen-1-ol, cis-beta-gamma-Hexenol, (Z)-Hex-2-enol, cis-1-Hydroxy-2-hexene, (Z)-Hex-2-ene-1-ol, SCHEMBL295023, cis-2-Hexen-1-ol, 95%, (2Z)-2-Hexen-1-ol #, CHEBI:195648, DTXCID001023122, LMFA05000115, AKOS015856217, HY-W127618, DB-254242, CS-0185821, H0751, NS00079667, cis-2-Hexen-1-ol, >=96%, stabilized, FG, D90941, Q1093153, 213-190-7 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 20.2 |
| Hydrogen Bond Donor Count | 1.0 |
| Pfizer 3 75 Rule | False |
| Np Classifier Class | Fatty alcohols |
| Deep Smiles | CCC/C=CCO |
| Heavy Atom Count | 7.0 |
| Classyfire Class | Fatty acyls |
| Classyfire Subclass | Fatty alcohols |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 48.1 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | (Z)-hex-2-en-1-ol |
| Veber Rule | True |
| Classyfire Superclass | Lipids and lipid-like molecules |
| Xlogp | 1.4 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C6H12O |
| Inchi Key | ZCHHRLHTBGRGOT-PLNGDYQASA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 3.0 |
| Synonyms | (z)-2-hexen-1-ol, (z)-2-hexenol |
| Esol Class | Very soluble |
| Functional Groups | C/C=CC, CO |
| Compound Name | 2-Hexen-1-ol, (2Z)- |
| Exact Mass | 100.089 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 100.089 |
| Hydrogen Bond Acceptor Count | 1.0 |
| Molecular Weight | 100.16 |
| Gi Absorption | True |
| 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/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3/b5-4- |
| Smiles | CCC/C=C\CO |
| Np Classifier Biosynthetic Pathway | Fatty acids |
| Defined Bond Stereocenter Count | 1.0 |
| Egan Rule | True |
| Np Classifier Superclass | Fatty acyls |
- 1. Outgoing r'ship
FOUND_INto/from Aster Ageratoides (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2008.9699408 - 2. Outgoing r'ship
FOUND_INto/from Carica Papaya (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.1248 - 3. Outgoing r'ship
FOUND_INto/from Carissa Carandas (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2004.9698764 - 4. Outgoing r'ship
FOUND_INto/from Citrus Limon (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2001.9699646 - 5. Outgoing r'ship
FOUND_INto/from Citrus Maxima (Plant) Rel Props:Reference:https://doi.org/10.1002/ffj.3239 - 6. Outgoing r'ship
FOUND_INto/from Clausena Lansium (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.1998.9701014 - 7. Outgoing r'ship
FOUND_INto/from Clinopodium Nubigenum (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2008.9700057 - 8. Outgoing r'ship
FOUND_INto/from Murraya Paniculata (Plant) Rel Props:Reference:ISBN:9770972795006 - 9. Outgoing r'ship
FOUND_INto/from Origanum Onites (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2006.9699077 - 10. Outgoing r'ship
FOUND_INto/from Pelargonium Graveolens (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2006.12067128 - 11. Outgoing r'ship
FOUND_INto/from Psidium Guajava (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2001.9699607 - 12. Outgoing r'ship
FOUND_INto/from Ribes Rubrum (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2018.1547226 - 13. Outgoing r'ship
FOUND_INto/from Spilanthes Acmella (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2005.9698952 - 14. Outgoing r'ship
FOUND_INto/from Vitis Vinifera (Plant) Rel Props:Reference:https://doi.org/10.1080/10412905.2010.9700415