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2-Ethyl-1-octene

HCID 550804
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Basic informationNames & identifiersPropertiesSafety & regulationRelated reactionsCompound notes
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Basic information

CAS
51655-64-2
Standard SMILES
C=C(CC)CCCCCC
InChIKey
XZJZVNABSFJYOK-UHFFFAOYSA-N
Molecular formula
C10H20
Average molar mass
140.27 g/mol
Monoisotopic mass
140.15650064

Names & identifiers

Preferred name
2-Ethyl-1-octene
IUPAC
3-methylidenenonane
English name
3-methylene-Nonane
Molecular formula
C10H20
Molecular weight
140.27

Names & synonyms

2-Ethyl-1-octene51655-64-2DTXSID10338720RefChem:471732DTXCID50289803811-345-93-methylidenenonane3-methylene-NonaneNonane, 3-methylene-2-ethyloct-1-ene2-Ethyl-1-octene #SCHEMBL73572
Show more names
SCHEMBL1173809SCHEMBL8210832SCHEMBL8218518SCHEMBL11339904SCHEMBL16288421DB-315502

Database identifiers

CAS
51655-64-2
PubChem CID
550804
DTXSID
DTXSID10338720
EC Number
811-345-9
Nikkaji
J121.023H

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
6
Heavy atoms
10
Formal charge
0
Complexity
82

Physicochemical properties

Melting point
-56.93 °C · -56.93°C (estimate)
Boiling point
166.82 °C · 166.82°C (estimate)
Density
0.7631 · 0.7631 (estimate)
refractive index
1.4177 · 1.4177 (estimate)
Symbol(GHS)
8 · GHS08,GHS02
Signal word
Danger
Hazard statements
304 · H304-H226
RIDADR
1993 · 1993
HazardClass
3.2 · 3.2
PackingGroup
III

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 · 4 items

Danger

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P280, P301+P316, P303+P361+P353, P331, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 129 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety data

ridadr
1993
Signal word
Danger
Symbol(GHS)
GHS08,GHS02
hazard_class
3.2
packing_group
III
Hazard statements
H304-H226

Related reactions

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Compound notes

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