Basic information
- CAS
5194-50-3- Standard SMILES
C/C=C\C=C\C- InChIKey
APPOKADJQUIAHP-CIIODKQPSA-N- Molecular formula
- C6H10
- Average molar mass
- 82.14 g/mol
- Monoisotopic mass
- 82.07825032
Overview
(E,Z)-2,4-Hexadiene is an alkadiene.
Names & identifiers
- Preferred name
- 2,4-Hexadiene, (2E,4Z)-
- IUPAC
- (2Z,4E)-hexa-2,4-diene
- English name
- 2,4-Hexadiene
- Molecular formula
- C6H10
- Molecular weight
- 82.14
Names & synonyms
cis,trans-Hexa-2,4-dienecis,trans-2,4-Hexadiene5194-50-3(E,Z)-2,4-Hexadiene(2E,4Z)-2,4-Hexadiene2,4-Hexadiene, (E,Z)-2,4-Hexadiene, (2E,4Z)-G4M9133VS9J211IEINECS 225-979-3DTXSID40873538RefChem:443896
Show more names
TRANS,TRANS-2,4-HEXADIENE2,4-Hexadienet,t-2,4-HEXADIENE2c,4t-2,4-Hexadiene2,4-hexadiene,(E,Z)-(2Z,4E)-2,4-Hexadiene
DTXCID901011772225-979-3(2Z,4E)-hexa-2,4-diene(E),(Z)-CH3CH=CHCH=CHCH3cis-2-trans-4-hexadieneUNII-G4M9133VS9(Z,E)-2,4-HexadieneSCHEMBL1760673
Database identifiers
- CAS
5194-50-3、592-46-1- PubChem CID
- 643786
- DTXSID
DTXSID40873538- ChEBI
CHEBI:229316- UNII
- G4M9133VS9
- EC Number
- 209-757-3、225-979-3
- Nikkaji
- J211I
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 48.4
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
LogP2.8
Physicochemical properties
- Melting point
- -96.1 °C · -96.1°C
- Boiling point
- 82 °C · 82 °C(lit.)
- Density
- 0.72 g/mL · 0.72 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.445(lit.)
- Flash point
- 7 °F · 7 °F
- Henry's Law Constant
- 6.8 · 6.8×10-5 mol/(m3Pa) at 25℃, Yaws (2003)
- FDA UNII
- 4 M9133VS9 · G4M9133VS9
- Hazard Codes
- F,Xi
- Risk Statements
- 11 · 11-36/37/38
- Safety Statements
- 16 · 16-26-36
- RIDADR
- 2458 · UN 2458 3/PG 2
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 46 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (100%)
Safety data
- wgk
- 3
- ridadr
- UN 2458 3/PG 2
- risk_code
- 11-36/37/38
- hazard_code
- F,Xi
- safety_code
- 16-26-36
- hazard_class
- 3.1
- packing_group
- II
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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