Basic information
- CAS
1647-16-1- Standard SMILES
C=CCCCCCCC=C- InChIKey
NLDGJRWPPOSWLC-UHFFFAOYSA-N- Molecular formula
- C10H18
- Average molar mass
- 138.25 g/mol
- Monoisotopic mass
- 138.14085058
Overview
1,9-Decadiene is an alkadiene.
Names & identifiers
- Preferred name
- 1,9-Decadiene
- IUPAC
- deca-1,9-diene
- English name
- 1,9-Decadiene
- Molecular formula
- C10H18
- Molecular weight
- 138.25
Names & synonyms
Show more names
Database identifiers
- CAS
1647-16-1- PubChem CID
- 15439
- DTXSID
DTXSID4022159- ChEMBL
CHEMBL31020- ChEBI
CHEBI:229289- UNII
- 2KWZ01G244
- EC Number
- 216-711-6
- Nikkaji
- J80.271I
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 70
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- -69.6 °C · -69.6°C (estimate)
- Boiling point
- 169 °C · 169 °C (lit.)
- Density
- 0.75 g/mL · 0.75 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.432(lit.)
- Flash point
- 107 °F · 107 °F
- storage temp.
- Flammables area
- solubility
- It is soluble in organic solvents.
- form
- Liquid
- Specific Gravity
- 0.75 · 0.75
- color
- Colorless to Light yellow
- explosive limit
- 0.7 % · 0.7%(V)
- BRN
- 1697870 · 1697870
- InChI
- InChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h3-4H,1-2,5-10H2
- InChIKey
- NLDGJRWPPOSWLC-UHFFFAOYSA-N
- SMILES
- C=CCCCCCCC=C
- CAS DataBase Reference
- 1647 · 1647-16-1(CAS DataBase Reference)
- FDA UNII
- 2 KWZ01G244 · 2KWZ01G244
- EPA Substance Registry System
- 1 · 1,9-Decadiene (1647-16-1)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 226 · H226-H315-H319-H335-H400
- Precautionary statements
- 210 · P210-P233-P240-P273-P303+P361+P353-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 10 · 10-36/37/38
- Safety Statements
- 26 · 26-36
- RIDADR
- 3295 · UN 3295 3/PG 3
- WGK Germany
- 3 · 3
- F
- 9 · 9
- TSCA
- TSCA listed
- HS Code
- 2901.29 · 2901.29.5000
- HazardClass
- 3 · 3
- PackingGroup
- III
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 1 Eye · Aquatic Acute 1Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 1.7% (1 of 60) of reports.
Warning
H226 (98.3%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 60 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- F
- 9
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3295 3/PG 3
- hs_code
- 2901.29.5000
- risk_code
- 10-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07,GHS09
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H226-H315-H319-H335-H400
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Hazard Classifications
- Aquatic Acute 1Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P233-P240-P273-P303+P361+P353-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
UsesIt is widely used in the manufacturers and suppliers of pharmaceuticals and intermediates in the preparation of fine chemicals. 1,9-decadiene is also used as a starting material in ADMET polymerizations .
General Description1,9-Decadiene acts as comonomer and undergoes acyclic diene metathesis (ADMET) copolymerization with 1, 5-hexadiene to form random linear polybutadiene –polyoctenamer copolymers. It undergoes ADMET copolymerization with divinyltetraethoxydisiloxane to yield siloxylene–vinylene–alkenylene copolymer.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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