Benzene, eicosyl-
Basic information
- CAS
2398-68-7- Standard SMILES
CCCCCCCCCCCCCCCCCCCCc1ccccc1- InChIKey
HPPLZROUJULWGU-UHFFFAOYSA-N- Molecular formula
- C26H46
- Average molar mass
- 358.6 g/mol
- Monoisotopic mass
- 358.35995147
Names & identifiers
- Preferred name
- Benzene, eicosyl-
- IUPAC
- icosylbenzene
- English name
- Eicosylbenzene standard for GC
- Molecular formula
- C26H46
- Molecular weight
- 358.64
Names & synonyms
Benzene, eicosyl-RefChem:562678634-990-61-PHENYLEICOSANEIcosylbenzene2398-68-7Eicosane, 1-phenyl-n-EicosylbenzeneIcosylbenzene #1-phenyl-eicosaneNSC123363SCHEMBL143463
Show more names
eicosylbenzene1-Phenylicosaneicosane,1-phenylbenzene,eicosyl-eicosane,1-phenyl-Eicosylbenzene standard for GC
SCHEMBL302781SCHEMBL1611454SCHEMBL2963936SCHEMBL3668533SCHEMBL5207581DTXSID50178703NSC 123363NSC-123363
Database identifiers
- CAS
2398-68-7- PubChem CID
- 16975
- DTXSID
DTXSID50178703- EC Number
- 634-990-6
- Nikkaji
- J114.033G
Properties
Computed structural properties
- XLogP
- 13.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 19
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 251
Physicochemical properties
- Melting point
- 40 · 40-43 °C
- Boiling point
- 426.03 °C · 426.03°C (estimate)
- Density
- 0.8632 · 0.8632 (estimate)
- refractive index
- 1.4805 · 1.4805
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H315-H318
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38-41-37/38
- Safety Statements
- 26 · 26-36-39
- 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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- wgk
- 3
- risk_code
- 36/37/38-41-37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- hazard_code
- Xi
- safety_code
- 26-36-39
- Hazard statements
- H335-H315-H318
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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