(E)-1-Heptenylboronic Acid

Product Information

Molecular Formula:
C7H15O2B
Molecular Weight:
142.00
Description
Reactant for: Suzuki-Miyaura alkenylation; Palladacycle-catalyzed asymmetric ring-opening reaction of oxabicyclic alkenes; Double Suzuki couplings; Rhodium-catalyzed asymmetric addition reactions.
Synonyms
[(E)-hept-1-enyl]boronic acid; [(E)-hept-1-enyl]boronic acid
IUPAC Name
[(E)-hept-1-enyl]boronic acid
Canonical SMILES
B(C=CCCCCC)(O)O
InChI
InChI=1S/C7H15BO2/c1-2-3-4-5-6-7-8(9)10/h6-7,9-10H,2-5H2,1H3/b7-6+
InChI Key
LDTJUGVTOZBIBN-VOTSOKGWSA-N
Boiling Point
245.7 °C at 760 mmHg
Melting Point
107-111 °C (lit.)
Flash Point
Not applicable
Density
0.918 g/cm3
Appearance
Grey solid
LogP
1.13490

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
5
Exact Mass
142.1165099 g/mol
Monoisotopic Mass
142.1165099 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
91.6
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
1
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
JP-2022021687-A Method for Producing N-Substituted (Meta) Acrylamide 2020-07-22
CN-111217693-A method for preparing a, β -unsaturated carboxylic acid by reacting alkenyl boron compound catalyzed by cuprous halide with carbon dioxide 2020-02-19
WO-2019147842-A1 Liquid crystal composition containing a five-membered heterocyclic ring, reverse-mode polymer dispersed liquid crystal element, and associated selectively dimmable device 2018-01-24
CN-111902519-A Liquid crystal composition comprising five-membered heterocyclic ring, reverse mode polymer dispersed liquid crystal element and related selectively dimmable device 2018-01-24
US-2020347302-A1 Liquid crystal composition containing a five-membered heterocyclic ring, reverse-mode polymer dispersed liquid crystal element, and associated selectively dimmable device 2018-01-24
JP-2021512209-A Liquid crystal compositions containing 5-membered heterocycles, reverse mode polymer dispersed liquid crystal devices, and related selective visualization devices. 2018-01-24
CA-3054300-A1 Curable and solvent soluble formulations and methods of making and using thereof 2017-02-22
EP-3585824-A2 Curable and solvent soluble formulations and methods of making and using thereof 2017-02-22
US-2020062877-A1 Curable and Solvent Soluble Formulations and Methods of Making and Using Therof 2017-02-22
WO-2018156766-A2 Curable and solvent soluble formulations and methods of making and using thereof 2017-02-22
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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