3-Cyclohexene-1-methanol - CAS 1679-51-2
Catalog: |
BB012436 |
Product Name: |
3-Cyclohexene-1-methanol |
CAS: |
1679-51-2 |
Synonyms: |
cyclohex-3-en-1-ylmethanol |
IUPAC Name: | cyclohex-3-en-1-ylmethanol |
Description: | 3-Cyclohexene-1-methanol (CAS# 1679-51-2) is a cyclohexene derivative found in essential oil of various citrus varieties. 3-Cyclohexene-1-methanol is used in the preparation of photo-cross-linkable polymers with redissolution property. |
Molecular Weight: | 112.17 |
Molecular Formula: | C7H12O |
Canonical SMILES: | C1CC(CC=C1)CO |
InChI: | InChI=1S/C7H12O/c8-6-7-4-2-1-3-5-7/h1-2,7-8H,3-6H2 |
InChI Key: | VEIYJWQZNGASMA-UHFFFAOYSA-N |
Boiling Point: | 190-192 °C |
Density: | 0.961 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00001574 |
LogP: | 1.33500 |
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PMID | Publication Date | Title | Journal |
22208224 | 20120601 | Immunotoxicity activity from the essential oils of coriander (Coriandrum sativum) seeds | Immunopharmacology and immunotoxicology |
18389065 | 20070101 | The nature of the chemical bond in linear three-body systems: from i3- to mixed chalcogen/halogen and trichalcogen moieties | Bioinorganic chemistry and applications |
15885448 | 20050601 | 3-Ethyl-2,7-dimethyl octane, a testosterone dependent unique urinary sex pheromone in male mouse (Mus musculus) | Animal reproduction science |
12916058 | 20030701 | Synthesis of novel MKC-442 analogues with potent activities against HIV-1 | Archiv der Pharmazie |
12571373 | 20021201 | Characterization of urinary volatiles in Swiss male mice (Mus musculus): bioassay of identified compounds | Journal of biosciences |
Complexity: | 86.4 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 112.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 112.088815002 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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