Basic information
- CAS
13049-40-6- Standard SMILES
CCc1ccc(-c2ccc(CC)cc2)cc1- InChIKey
UMSGIWAAMHRVQI-UHFFFAOYSA-N- Molecular formula
- C16H18
- Average molar mass
- 210.31 g/mol
- Monoisotopic mass
- 210.14085057
Names & identifiers
- Preferred name
- 4,4'-Diethylbiphenyl
- IUPAC
- 1-ethyl-4-(4-ethylphenyl)benzene
- English name
- 4,4'-DIETHYLBIPHENYL
- Molecular formula
- C16H18
- Molecular weight
- 210.31
Names & synonyms
4,4'-DIETHYLBIPHENYL13049-40-657364-79-1RefChem:506641680-147-01-ethyl-4-(4-ethylphenyl)benzene4,4'-DIETHYL-1,1'-BIPHENYL1,1'-Biphenyl, 4,4'-diethyl-4,4/'-DiethylbiphenylMFCD067970934,4'-diethyl-biphenylSCHEMBL1702558
Show more names
4,4-Diethlbiphenyl4,4'-Diethylbiphenyl>4,4''-DIETHLBIPHENYL EP
SCHEMBL15064092DTXSID10926762UMSGIWAAMHRVQI-UHFFFAOYSA-NAKOS015918082AS-59426SY054414CS-0324584D2938
Database identifiers
- CAS
13049-40-6、57364-79-1- PubChem CID
- 42292
- DTXSID
DTXSID10926762- EC Number
- 680-147-0
- Nikkaji
- J105.843F
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 158
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical structure
Physicochemical properties
- Melting point
- 82 °C · 82 °C
- Boiling point
- 315 °C · 315 °C
- Density
- 0.998 g/cm3 · 0.998 g/cm3(Temp: 17 °C)
- form
- powder to crystal
- color
- White to Almost white
- CAS DataBase Reference
- 13049 · 13049-40-6
- Symbol(GHS)
- 7 · GHS07,GHS08,GHS09
- Signal word
- Danger
- Hazard statements
- 413 · H413
- Precautionary statements
- 273 · P273-P501
- HS Code
- 2902.9 · 2902.90.9000
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
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, 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.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- hs_code
- 2902.90.9000
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS08,GHS09
- Hazard statements
- H413
- Precautionary statements
- P273-P501
Chemistry & industry
Suppliers27 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海鑫凯化学科技有限公司021-58930698 15921516558 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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