1,2-Hexadiene structure

1,2-Hexadiene

hexa-1,2-diene

Also Known As: 1,2-Hexadiene|hexa-1,2-diene|CH2=C=CHCH2C2H5|acetic acid 3-bromopropyl ester|1/C6H10/c1-3-5-6-4-2/h5H,1,4,6H2,2H

CAS: 592-44-9
Molecular Formula CCCC=C=C
Molecular Weight 82.07825 g/mol
LogP 2.0
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 0
Rotatable Bonds 2
Exact Mass 82.07825
Monoisotopic Mass 82.07825
Heavy Atoms 6
Complexity 56.0

Chemical Identifiers

CAS Number 592-44-9
SMILES CCCC=C=C
InChIKey XIAJQOBRHVKGSP-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (15 patents) Analytical Reagents (8 patents) Biotechnology (18 patents) Catalysts (74 patents) Coatings & Adhesives (38 patents) Construction Chemicals (2 patents) Dyes & Pigments (12 patents) Electronic Chemicals (1 patents) Heterocyclic Building Blocks (389 patents) Lubricants & Additives (4 patents) Organic Building Blocks (247 patents) Organometallic Reagents (24 patents) Peptides & Amino Acids (14 patents) Pharmaceutical Intermediates (330 patents) Photographic Chemicals (44 patents) Plastic Additives (31 patents) Polymer Intermediates (241 patents) Specialty Chemicals (15 patents) Surfactants & Detergents (1 patents) Textile Chemicals (1 patents)

Product Overview

1,2-Hexadiene (CAS 592-44-9), with molecular formula CCCC=C=C and molecular weight 82.07825 g/mol. IUPAC: hexa-1,2-diene.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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