1-Methoxyoctane

HCID 70247

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 929-56-6
Standard SMILES: CCCCCCCCOC
InChIKey: RIAWWRJHTAZJSU-UHFFFAOYSA-N
Molecular formula: C9H20O
Average molar mass: 144.25 g/mol
Monoisotopic mass: 144.15141526

Names & identifiers

Preferred name: 1-Methoxyoctane
IUPAC: 1-methoxyoctane
English name: 1-Methoxyoctane
Molecular formula: C9H20O
Molecular weight: 144.25

Names & synonyms

1-MethoxyoctaneOctane, 1-methoxy-Octyl methyl etherMethyl octyl ethern-Octyl methyl etherEther, methyl octylEINECS 213-201-5DTXSID40239190RefChem:76181DTXCID60161681213-201-5RIAWWRJHTAZJSU-UHFFFAOYSA-N

Show more names

Methyloctylether

929-56-6methoxyoctaneSCHEMBL92148SCHEMBL167832SCHEMBL198337SCHEMBL980187SCHEMBL2955465SCHEMBL4339778

Database identifiers

CAS: 929-56-6
PubChem CID: 70247
DTXSID: DTXSID40239190
EC Number: 213-201-5
Nikkaji: J298.507A

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 7
Heavy atoms: 10
Formal charge: 0
Complexity: 52.7

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical shift

Physicochemical properties

Melting point: -68.3 °C · -68.3°C (estimate)
Boiling point: 162.9 °C · 162.9°C (estimate)
Density: 0.7892 · 0.7892 (estimate)
refractive index: 1.4022 · 1.4022 (estimate)
LogP: 3.588 · 3.588 (est)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36/37/39
HS Code: 2909199090 · 2909199090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Safety data

hs_code: 2909199090
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
safety_code: 26-36/37/39
Hazard statements: H315-H319
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P