trans-3-Hexene - CAS 13269-52-8
Catalog: |
BB007620 |
Product Name: |
trans-3-Hexene |
CAS: |
13269-52-8 |
Synonyms: |
(E)-hex-3-ene |
IUPAC Name: | (E)-hex-3-ene |
Description: | trans-3-Hexene (CAS# 13269-52-8 ) is a useful research chemical. |
Molecular Weight: | 84.16 |
Molecular Formula: | C6H12 |
Canonical SMILES: | CCC=CCC |
InChI: | InChI=1S/C6H12/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3/b6-5+ |
InChI Key: | ZQDPJFUHLCOCRG-AATRIKPKSA-N |
Boiling Point: | 66 °C |
Melting Point: | -113 °C |
Purity: | 95 % |
Density: | 0.677 g/mL at 25 °C(lit.) |
Appearance: | Colorless liquid |
Storage: | Flammables area |
MDL: | MFCD00009386 |
LogP: | 2.36260 |
Vapor Pressure: | 165.0 [mmHg] |
GHS Hazard Statement: | H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P301+P310, P303+P361+P353, P331, P370+P378, P403+P235, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021201040-A1 | Interlayer film for laminated glass, and laminated glass | 20200331 |
WO-2021191175-A1 | Detergent formulation in form of a three dimensional body | 20200324 |
JP-2021147287-A | Thermoplastic film and laminated glass | 20200319 |
JP-2021147288-A | Thermoplastic film and laminated glass | 20200319 |
WO-2021176009-A1 | Process for preparing perfuming intermediate | 20200305 |
PMID | Publication Date | Title | Journal |
22713106 | 20120725 | Borenium ion catalyzed hydroboration of alkenes with N-heterocyclic carbene-boranes | Journal of the American Chemical Society |
21247150 | 20110216 | Bis-N-heterocyclic carbene palladium(IV) tetrachloride complexes: synthesis, reactivity, and mechanisms of direct chlorinations and oxidations of organic substrates | Journal of the American Chemical Society |
20192165 | 20100319 | Versatile intramolecular aza-Prins and Prins cyclization of aryl epoxides: a facile synthesis of diaza-, oxa-aza-, and dioxa-bicycles | The Journal of organic chemistry |
21579982 | 20091224 | catena-Poly[[trimethyl-tin(IV)]-μ-cyclo-hex-3-ene-1-carboxyl-ato] | Acta crystallographica. Section E, Structure reports online |
19123845 | 20090129 | In situ IR spectroscopy and ab initio calculations to study polymer swelling by supercritical CO(2) | The journal of physical chemistry. B |
Complexity: | 29.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 84.093900383 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 84.093900383 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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