Basic information
- Standard SMILES
CCc1ccc(-c2ccccc2)cc1- InChIKey
SRQOBNUBCLPPPH-UHFFFAOYSA-N- Molecular formula
- C14H14
- Average molar mass
- 182.26 g/mol
- Monoisotopic mass
- 182.10955045
Names & identifiers
- Preferred name
- 4-Ethylbiphenyl
- IUPAC
- 1-ethyl-4-phenylbenzene
- English name
- 4-Ethylbiphenyl
- Molecular formula
- C14H14
- Molecular weight
- 182.26
Names & synonyms
4-Ethylbiphenyl4-Ethyl-1,1'-biphenyl1-Ethyl-4-phenylbenzene1,1'-Biphenyl, 4-ethyl-L7NF2489BSNSC 60063NSC-60063DTXSID7073355RefChem:98898DTXCID00421631,1'-Biphenyl, 4-ethyl-(9CI)679-980-2
Show more names
4-Ethylbiphenyl>4-Ethylbiphenyl,99%1’-Biphenyl,4-ethyl-1
SRQOBNUBCLPPPH-UHFFFAOYSA-N5707-44-8p-EthylbiphenylBiphenyl, 4-ethyl-MFCD000102364-Ethyl biphenyl4-ethyl-biphenylNSC60063
Database identifiers
- CAS
5707-44-8- PubChem CID
- 79786
- DTXSID
DTXSID7073355- UNII
- L7NF2489BS
- EC Number
- 679-980-2
- Nikkaji
- J3.823G
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 147
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical structure
Physicochemical properties
- Melting point
- 34 · 34-35.5°C
- Boiling point
- 149 · 149-149.8°C (12 mmHg)
- Density
- 0.99 · 0.9900 (estimate)
- refractive index
- 1.579 · 1.5790 (estimate)
- Flash point
- 110 °C · >110°C
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- Light yellow to yellow Solid
- BRN
- 1904973 · 1904973
- InChI
- InChI=1S/C14H14/c1-2-12-8-10-14(11-9-12)13-6-4-3-5-7-13/h3-11H,2H2,1H3
- InChIKey
- SRQOBNUBCLPPPH-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=CC=C2)=CC=C(CC)C=C1
- CAS DataBase Reference
- 5707 · 5707-44-8(CAS DataBase Reference)
- FDA UNII
- 7 NF2489BS · L7NF2489BS
- NIST Chemistry Reference
- 4 · 4-Ethylbiphenyl(5707-44-8)
- EPA Substance Registry System
- 1 · 1,1'-Biphenyl, 4-ethyl- (5707-44-8)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
- Safety Statements
- 24 · 24/25
- RIDADR
- 3077 · 3077
- HazardClass
- 9 · 9
- PackingGroup
- III
- HS Code
- 29029090 · 29029090
Safety & regulation
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Warning
H302: Harmful if swallowed [Warning Acute toxicity, oral]
Hazard information
Hazard Classes and Categories
Aquatic Acute 1 (100%)
Acute toxicity (Oral) - Category 4
Safety data
- ridadr
- 3077
- hs_code
- 29029090
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- safety_code
- 24/25
- hazard_class
- 9
- packing_group
- III
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Applications
UsesIntermediates of Liquid Crystals
Suppliers50 total
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